8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane

C89H93ClN6O6Si3+6 — CID 91152781

About 8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane

8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane (PubChem CID 91152781) has the molecular formula C89H93ClN6O6Si3+6 and a molecular weight of 1462.47 g/mol. Its IUPAC name is 8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane.

Molecular Properties

• Compound Name: 8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane
• PubChem CID: 91152781
• Molecular Formula: C89H93ClN6O6Si3+6
• Molecular Weight: 1462.47 g/mol
• Exact Mass: 1460.61
• IUPAC Name: 8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane
• SMILES: C[Si](C)(C)c1cccc2[n+]1COc1ccccc1-2.C[Si](C)(C)c1cccc2c1OC[n+]1c-2cccc1[Si](C)(C)C.Cc1cccc2[n+]1COc1c-2ccc2ccccc12.Cc1cccc2c1OC[n+]1c(C)cccc1-2.Cc1cccc2c1OC[n+]1ccccc1-2.Clc1cccc2[n+]1COc1ccccc1-2
• InChI: InChI=1S/C18H26NOSi2.C17H14NO.C15H18NOSi.C14H14NO.C13H12NO.C12H9ClNO/c1-21(2,3)16-11-7-9-14-15-10-8-12-17(22(4,5)6)19(15)13-20-18(14)16;1-12-5-4-8-16-15-10-9-13-6-2-3-7-14(13)17(15)19-11-18(12)16;1-18(2,3)15-10-6-8-13-12-7-4-5-9-14(12)17-11-16(13)15;1-10-5-3-7-12-13-8-4-6-11(2)15(13)9-16-14(10)12;1-10-5-4-6-11-12-7-2-3-8-14(12)9-15-13(10)11;13-12-7-3-5-10-9-4-1-2-6-11(9)15-8-14(10)12/h7-12H,13H2,1-6H3;2-10H,11H2,1H3;4-10H,11H2,1-3H3;3-8H,9H2,1-2H3;2-8H,9H2,1H3;1-7H,8H2/q6*+1
• InChIKey: IKDYOKGEJZIORH-UHFFFAOYSA-N
• XLogP: 16.62
• TPSA: 78.66 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 105
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1462.47
LogP ≤ 5	16.62
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane?

The IUPAC name of 8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane (CID 91152781) is 8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane.

What is the SMILES notation for 8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane?

The canonical SMILES for 8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane is C[Si](C)(C)c1cccc2[n+]1COc1ccccc1-2.C[Si](C)(C)c1cccc2c1OC[n+]1c-2cccc1[Si](C)(C)C.Cc1cccc2[n+]1COc1c-2ccc2ccccc12.Cc1cccc2c1OC[n+]1c(C)cccc1-2.Cc1cccc2c1OC[n+]1ccccc1-2.Clc1cccc2[n+]1COc1ccccc1-2.

What is the InChIKey of 8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane?

The InChIKey is IKDYOKGEJZIORH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26NOSi2.C17H14NO.C15H18NOSi.C14H14NO.C13H12NO.C12H9ClNO/c1-21(2,3)16-11-7-9-14-15-10-8-12-17(22(4,5)6)19(15)13-20-18(14)16;1-12-5-4-8-16-15-10-9-13-6-2-3-7-14(13)17(15)19-11-18(12)16;1-18(2,3)15-10-6-8-13-12-7-4-5-9-14(12)17-11-16(13)15;1-10-5-3-7-12-13-8-4-6-11(2)15(13)9-16-14(10)12;1-10-5-4-6-11-12-7-2-3-8-14(12)9-15-13(10)11;13-12-7-3-5-10-9-4-1-2-6-11(9)15-8-14(10)12/h7-12H,13H2,1-6H3;2-10H,11H2,1H3;4-10H,11H2,1-3H3;3-8H,9H2,1-2H3;2-8H,9H2,1H3;1-7H,8H2/q6*+1.

What are the key properties of 8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane?

8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane has a molecular weight of 1462.47 g/mol, XLogP of 16.62, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 8-chloro-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;4,8-dimethyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;6-methyl-9-oxa-7-azoniatetracyclo[8.8.0.02,7.011,16]octadeca-1(10),2,4,6,11,13,15,17-octaene;4-methyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium;trimethyl(6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane;trimethyl-(4-trimethylsilyl-6H-pyrido[1,2-c][1,3]benzoxazin-7-ium-8-yl)silane is sourced from PubChem (CID 91152781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).