N-hexyl-1-[10-[4-(hexylcarbamoyl)pyridin-1-ium-1-yl]decyl]pyridin-1-ium-4-carboxamide bromide

Systemtic Name: N-hexyl-1-[10-[4-(hexylcarbamoyl)pyridin-1-ium-1-yl]decyl]pyridin-1-ium-4-carboxamide bromide Openeye Name: N-hexyl-1-[10-[4-(hexylcarbamoyl)pyridin-1-ium-1-yl]decyl]pyridin-1-ium-4-carboxamide bromide CAS Name: N-hexyl-1-[10-[4-[(hexylamino)-oxomethyl]-1-pyridin-1-iumyl]decyl]-4-pyridin-1-iumcarboxamide bromide IUPAC Name: N-hexyl-1-[10-[4-(hexylcarbamoyl)pyridin-1-ium-1-yl]decyl]pyridin-1-ium-4-carboxamide bromide Traditional Name: N-hexyl-1-[10-[4-(hexylcarbamoyl)pyridin-1-ium-1-yl]decyl]pyridin-1-ium-4-carboxamide bromide Formula: C34H56BrN4O2+ MolecularWeight: 632.73804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CC=[N+](C=C1)CCCCCCCCCC[N+]2=CC=C(C=C2)C(=O)NCCCCCC.[Br-]

Isomeric SMILES

CCCCCCNC(=O)C1=CC=[N+](C=C1)CCCCCCCCCC[N+]2=CC=C(C=C2)C(=O)NCCCCCC.[Br-]

InChI

InChI=1S/C34H54N4O2.BrH/c1-3-5-7-15-23-35-33(39)31-19-27-37(28-20-31)25-17-13-11-9-10-12-14-18-26-38-29-21-32(22-30-38)34(40)36-24-16-8-6-4-2;/h19-22,27-30H,3-18,23-26H2,1-2H3;1H/p+1