About N-[4-[4-[42,51-bis[4-[[4-[4-(methoxymethyl)-N-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]anilino]phenyl]methoxymethyl]phenyl]-30-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]-9,18-bis[4-(methoxymethyl)phenyl]-3,24,36,57-tetraoxa-9,18,30,42,51,63-hexazatridecacyclo[62.2.2.25,8.210,13.214,17.219,22.226,29.231,34.238,41.243,46.247,50.252,55.259,62]nonaconta-1(67),5,7,10,12,14,16,19,21,26,28,31,33,38(78),39,41(77),43(76),44,46(75),47(74),48,50(73),52(72),53,55(71),59(70),60,62(69),64(68),65,79,81,83,85,87,89-hexatriacontaen-63-yl]phenyl]phenyl]-4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]aniline
N-[4-[4-[42,51-bis[4-[[4-[4-(methoxymethyl)-N-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]anilino]phenyl]methoxymethyl]phenyl]-30-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]-9,18-bis[4-(methoxymethyl)phenyl]-3,24,36,57-tetraoxa-9,18,30,42,51,63-hexazatridecacyclo[62.2.2.25,8.210,13.214,17.219,22.226,29.231,34.238,41.243,46.247,50.252,55.259,62]nonaconta-1(67),5,7,10,12,14,16,19,21,26,28,31,33,38(78),39,41(77),43(76),44,46(75),47(74),48,50(73),52(72),53,55(71),59(70),60,62(69),64(68),65,79,81,83,85,87,89-hexatriacontaen-63-yl]phenyl]phenyl]-4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]aniline (PubChem CID 171418983) has the molecular formula C252H228N12O18
and a molecular weight of 3712.66 g/mol. Its IUPAC name is N-[4-[4-[42,51-bis[4-[[4-[4-(methoxymethyl)-N-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]anilino]phenyl]methoxymethyl]phenyl]-30-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]-9,18-bis[4-(methoxymethyl)phenyl]-3,24,36,57-tetraoxa-9,18,30,42,51,63-hexazatridecacyclo[62.2.2.25,8.210,13.214,17.219,22.226,29.231,34.238,41.243,46.247,50.252,55.259,62]nonaconta-1(67),5,7,10,12,14,16,19,21,26,28,31,33,38(78),39,41(77),43(76),44,46(75),47(74),48,50(73),52(72),53,55(71),59(70),60,62(69),64(68),65,79,81,83,85,87,89-hexatriacontaen-63-yl]phenyl]phenyl]-4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]aniline.
Frequently Asked Questions
What is the IUPAC name of N-[4-[4-[42,51-bis[4-[[4-[4-(methoxymethyl)-N-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]anilino]phenyl]methoxymethyl]phenyl]-30-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]-9,18-bis[4-(methoxymethyl)phenyl]-3,24,36,57-tetraoxa-9,18,30,42,51,63-hexazatridecacyclo[62.2.2.25,8.210,13.214,17.219,22.226,29.231,34.238,41.243,46.247,50.252,55.259,62]nonaconta-1(67),5,7,10,12,14,16,19,21,26,28,31,33,38(78),39,41(77),43(76),44,46(75),47(74),48,50(73),52(72),53,55(71),59(70),60,62(69),64(68),65,79,81,83,85,87,89-hexatriacontaen-63-yl]phenyl]phenyl]-4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]aniline?
The IUPAC name of N-[4-[4-[42,51-bis[4-[[4-[4-(methoxymethyl)-N-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]anilino]phenyl]methoxymethyl]phenyl]-30-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]-9,18-bis[4-(methoxymethyl)phenyl]-3,24,36,57-tetraoxa-9,18,30,42,51,63-hexazatridecacyclo[62.2.2.25,8.210,13.214,17.219,22.226,29.231,34.238,41.243,46.247,50.252,55.259,62]nonaconta-1(67),5,7,10,12,14,16,19,21,26,28,31,33,38(78),39,41(77),43(76),44,46(75),47(74),48,50(73),52(72),53,55(71),59(70),60,62(69),64(68),65,79,81,83,85,87,89-hexatriacontaen-63-yl]phenyl]phenyl]-4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]aniline (CID 171418983) is N-[4-[4-[42,51-bis[4-[[4-[4-(methoxymethyl)-N-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]anilino]phenyl]methoxymethyl]phenyl]-30-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]-9,18-bis[4-(methoxymethyl)phenyl]-3,24,36,57-tetraoxa-9,18,30,42,51,63-hexazatridecacyclo[62.2.2.25,8.210,13.214,17.219,22.226,29.231,34.238,41.243,46.247,50.252,55.259,62]nonaconta-1(67),5,7,10,12,14,16,19,21,26,28,31,33,38(78),39,41(77),43(76),44,46(75),47(74),48,50(73),52(72),53,55(71),59(70),60,62(69),64(68),65,79,81,83,85,87,89-hexatriacontaen-63-yl]phenyl]phenyl]-4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]aniline.
What is the SMILES notation for N-[4-[4-[42,51-bis[4-[[4-[4-(methoxymethyl)-N-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]anilino]phenyl]methoxymethyl]phenyl]-30-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]-9,18-bis[4-(methoxymethyl)phenyl]-3,24,36,57-tetraoxa-9,18,30,42,51,63-hexazatridecacyclo[62.2.2.25,8.210,13.214,17.219,22.226,29.231,34.238,41.243,46.247,50.252,55.259,62]nonaconta-1(67),5,7,10,12,14,16,19,21,26,28,31,33,38(78),39,41(77),43(76),44,46(75),47(74),48,50(73),52(72),53,55(71),59(70),60,62(69),64(68),65,79,81,83,85,87,89-hexatriacontaen-63-yl]phenyl]phenyl]-4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]aniline?
The canonical SMILES for N-[4-[4-[42,51-bis[4-[[4-[4-(methoxymethyl)-N-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]anilino]phenyl]methoxymethyl]phenyl]-30-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]-9,18-bis[4-(methoxymethyl)phenyl]-3,24,36,57-tetraoxa-9,18,30,42,51,63-hexazatridecacyclo[62.2.2.25,8.210,13.214,17.219,22.226,29.231,34.238,41.243,46.247,50.252,55.259,62]nonaconta-1(67),5,7,10,12,14,16,19,21,26,28,31,33,38(78),39,41(77),43(76),44,46(75),47(74),48,50(73),52(72),53,55(71),59(70),60,62(69),64(68),65,79,81,83,85,87,89-hexatriacontaen-63-yl]phenyl]phenyl]-4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]aniline is COCc1ccc(N(c2ccc(COC)cc2)c2ccc(-c3ccc(N(c4ccc(COC)cc4)c4ccc(COCc5ccc(N6c7ccc(cc7)COCc7ccc(cc7)N(c7ccc(-c8ccc(N(c9ccc(COC)cc9)c9ccc(COC)cc9)cc8)cc7)c7ccc(cc7)COCc7ccc(cc7)N(c7ccc(COC)cc7)c7ccc(cc7)-c7ccc(cc7)N(c7ccc(COC)cc7)c7ccc(cc7)COCc7ccc(cc7)N(c7ccc(-c8ccc(N(c9ccc(COC)cc9)c9ccc(COC)cc9)cc8)cc7)c7ccc(cc7)COCc7ccc(cc7)N(c7ccc(COCc8ccc(N(c9ccc(COC)cc9)c9ccc(-c%10ccc(N(c%11ccc(COC)cc%11)c%11ccc(COC)cc%11)cc%10)cc9)cc8)cc7)c7ccc(cc7)-c7ccc6cc7)cc5)cc4)cc3)cc2)cc1.
What is the InChIKey of N-[4-[4-[42,51-bis[4-[[4-[4-(methoxymethyl)-N-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]anilino]phenyl]methoxymethyl]phenyl]-30-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]-9,18-bis[4-(methoxymethyl)phenyl]-3,24,36,57-tetraoxa-9,18,30,42,51,63-hexazatridecacyclo[62.2.2.25,8.210,13.214,17.219,22.226,29.231,34.238,41.243,46.247,50.252,55.259,62]nonaconta-1(67),5,7,10,12,14,16,19,21,26,28,31,33,38(78),39,41(77),43(76),44,46(75),47(74),48,50(73),52(72),53,55(71),59(70),60,62(69),64(68),65,79,81,83,85,87,89-hexatriacontaen-63-yl]phenyl]phenyl]-4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]aniline?
The InChIKey is PFECIYUOZJJCFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C252H228N12O18/c1-265-157-181-13-85-217(86-14-181)253(218-87-15-182(16-88-218)158-266-2)241-133-61-205(62-134-241)209-69-141-245(142-70-209)257(225-101-29-189(30-102-225)165-273-9)229-109-37-193(38-110-229)169-277-175-199-49-121-237(122-50-199)263-239-129-57-203(58-130-239)179-281-177-201-53-125-235(126-54-201)261(249-149-77-213(78-150-249)207-65-137-243(138-66-207)255(221-93-21-185(22-94-221)161-269-5)222-95-23-186(24-96-222)162-270-6)233-117-45-197(46-118-233)173-279-171-195-41-113-231(114-42-195)259(227-105-33-191(34-106-227)167-275-11)247-145-73-211(74-146-247)212-75-147-248(148-76-212)260(228-107-35-192(36-108-228)168-276-12)232-115-43-196(44-116-232)172-280-174-198-47-119-234(120-48-198)262(250-151-79-214(80-152-250)208-67-139-244(140-68-208)256(223-97-25-187(26-98-223)163-271-7)224-99-27-188(28-100-224)164-272-8)236-127-55-202(56-128-236)178-282-180-204-59-131-240(132-60-204)264(252-155-83-216(84-156-252)215-81-153-251(263)154-82-215)238-123-51-200(52-124-238)176-278-170-194-39-111-230(112-40-194)258(226-103-31-190(32-104-226)166-274-10)246-143-71-210(72-144-246)206-63-135-242(136-64-206)254(219-89-17-183(18-90-219)159-267-3)220-91-19-184(20-92-220)160-268-4/h13-156H,157-180H2,1-12H3.
What are the key properties of N-[4-[4-[42,51-bis[4-[[4-[4-(methoxymethyl)-N-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]anilino]phenyl]methoxymethyl]phenyl]-30-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]-9,18-bis[4-(methoxymethyl)phenyl]-3,24,36,57-tetraoxa-9,18,30,42,51,63-hexazatridecacyclo[62.2.2.25,8.210,13.214,17.219,22.226,29.231,34.238,41.243,46.247,50.252,55.259,62]nonaconta-1(67),5,7,10,12,14,16,19,21,26,28,31,33,38(78),39,41(77),43(76),44,46(75),47(74),48,50(73),52(72),53,55(71),59(70),60,62(69),64(68),65,79,81,83,85,87,89-hexatriacontaen-63-yl]phenyl]phenyl]-4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]aniline?
N-[4-[4-[42,51-bis[4-[[4-[4-(methoxymethyl)-N-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]anilino]phenyl]methoxymethyl]phenyl]-30-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]-9,18-bis[4-(methoxymethyl)phenyl]-3,24,36,57-tetraoxa-9,18,30,42,51,63-hexazatridecacyclo[62.2.2.25,8.210,13.214,17.219,22.226,29.231,34.238,41.243,46.247,50.252,55.259,62]nonaconta-1(67),5,7,10,12,14,16,19,21,26,28,31,33,38(78),39,41(77),43(76),44,46(75),47(74),48,50(73),52(72),53,55(71),59(70),60,62(69),64(68),65,79,81,83,85,87,89-hexatriacontaen-63-yl]phenyl]phenyl]-4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]aniline has a molecular weight of 3712.66 g/mol, XLogP of 63.70, 60 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-[42,51-bis[4-[[4-[4-(methoxymethyl)-N-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]anilino]phenyl]methoxymethyl]phenyl]-30-[4-[4-[4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]anilino]phenyl]phenyl]-9,18-bis[4-(methoxymethyl)phenyl]-3,24,36,57-tetraoxa-9,18,30,42,51,63-hexazatridecacyclo[62.2.2.25,8.210,13.214,17.219,22.226,29.231,34.238,41.243,46.247,50.252,55.259,62]nonaconta-1(67),5,7,10,12,14,16,19,21,26,28,31,33,38(78),39,41(77),43(76),44,46(75),47(74),48,50(73),52(72),53,55(71),59(70),60,62(69),64(68),65,79,81,83,85,87,89-hexatriacontaen-63-yl]phenyl]phenyl]-4-(methoxymethyl)-N-[4-(methoxymethyl)phenyl]aniline is sourced from PubChem (CID 171418983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).