1-[2-oxidanylidene-2-[(2-phenylazanylphenyl)amino]ethyl]pyridin-1-ium-3-carboxamide chloride

Systemtic Name: 1-[2-oxidanylidene-2-[(2-phenylazanylphenyl)amino]ethyl]pyridin-1-ium-3-carboxamide chloride Openeye Name: 1-[2-(2-anilinoanilino)-2-oxo-ethyl]pyridin-1-ium-3-carboxamide chloride CAS Name: 1-[2-(2-anilinoanilino)-2-oxoethyl]-3-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-[2-(2-anilinoanilino)-2-oxoethyl]pyridin-1-ium-3-carboxamide chloride Traditional Name: 1-[2-(2-anilinoanilino)-2-keto-ethyl]pyridin-1-ium-3-carboxamide chloride Formula: C20H19ClN4O2 MolecularWeight: 382.84346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=CC=C2NC(=O)C[N+]3=CC=CC(=C3)C(=O)N.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=CC=C2NC(=O)C[N+]3=CC=CC(=C3)C(=O)N.[Cl-]

InChI

InChI=1S/C20H18N4O2.ClH/c21-20(26)15-7-6-12-24(13-15)14-19(25)23-18-11-5-4-10-17(18)22-16-8-2-1-3-9-16;/h1-13,22H,14H2,(H2-,21,23,25,26);1H