10-[4,9-bis(azanyl)-2-phenyl-benzo[h]quinolin-1-ium-1-yl]decyl-trimethyl-azanium dichloride

Systemtic Name: 10-[4,9-bis(azanyl)-2-phenyl-benzo[h]quinolin-1-ium-1-yl]decyl-trimethyl-azanium dichloride Openeye Name: 10-(4,9-diamino-2-phenyl-benzo[h]quinolin-1-ium-1-yl)decyl-trimethyl-ammonium dichloride CAS Name: 10-(4,9-diamino-2-phenyl-1-benzo[h]quinolin-1-iumyl)decyl-trimethylammonium dichloride IUPAC Name: 10-(4,9-diamino-2-phenylbenzo[h]quinolin-1-ium-1-yl)decyl-trimethylazanium dichloride Traditional Name: 10-(4,9-diamino-2-phenyl-benzo[h]quinolin-1-ium-1-yl)decyl-trimethyl-ammonium dichloride Formula: C32H44Cl2N4 MolecularWeight: 555.62456

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCCCCCCCC[N+]1=C(C=C(C2=C1C3=C(C=CC(=C3)N)C=C2)N)C4=CC=CC=C4.[Cl-].[Cl-]

Isomeric SMILES

C[N+](C)(C)CCCCCCCCCC[N+]1=C(C=C(C2=C1C3=C(C=CC(=C3)N)C=C2)N)C4=CC=CC=C4.[Cl-].[Cl-]

InChI

InChI=1S/C32H43N4.2ClH/c1-36(2,3)22-14-9-7-5-4-6-8-13-21-35-31(26-15-11-10-12-16-26)24-30(34)28-20-18-25-17-19-27(33)23-29(25)32(28)35;;/h10-12,15-20,23-24,34H,4-9,13-14,21-22,33H2,1-3H3;2*1H/q+1;;/p-1