6-[4-(diphenylmethyl)piperazin-4-ium-1-yl]pyridin-1-ium-3-carboxamide

Systemtic Name: 6-[4-(diphenylmethyl)piperazin-4-ium-1-yl]pyridin-1-ium-3-carboxamide Openeye Name: 6-(4-benzhydrylpiperazin-4-ium-1-yl)pyridin-1-ium-3-carboxamide CAS Name: 6-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 6-(4-benzhydrylpiperazin-4-ium-1-yl)pyridin-1-ium-3-carboxamide Traditional Name: 6-(4-benzhydrylpiperazin-4-ium-1-yl)pyridin-1-ium-3-carboxamide Formula: C23H26N4O+2 MolecularWeight: 374.47874

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=[NH+]C=C(C=C4)C(=O)N

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=[NH+]C=C(C=C4)C(=O)N

InChI

InChI=1S/C23H24N4O/c24-23(28)20-11-12-21(25-17-20)26-13-15-27(16-14-26)22(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-12,17,22H,13-16H2,(H2,24,28)/p+2