N-(2-methoxyphenyl)-4-[(phenylmethyl)amino]pyridin-1-ium-2-carboxamide

Systemtic Name: N-(2-methoxyphenyl)-4-[(phenylmethyl)amino]pyridin-1-ium-2-carboxamide Openeye Name: 4-(benzylamino)-N-(2-methoxyphenyl)pyridin-1-ium-2-carboxamide CAS Name: N-(2-methoxyphenyl)-4-[(phenylmethyl)amino]-2-pyridin-1-iumcarboxamide IUPAC Name: 4-(benzylamino)-N-(2-methoxyphenyl)pyridin-1-ium-2-carboxamide Traditional Name: 4-(benzylamino)-N-(2-methoxyphenyl)pyridin-1-ium-2-carboxamide Formula: C20H20N3O2+ MolecularWeight: 334.3917

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=[NH+]C=CC(=C2)NCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=[NH+]C=CC(=C2)NCC3=CC=CC=C3

InChI

InChI=1S/C20H19N3O2/c1-25-19-10-6-5-9-17(19)23-20(24)18-13-16(11-12-21-18)22-14-15-7-3-2-4-8-15/h2-13H,14H2,1H3,(H,21,22)(H,23,24)/p+1