[2-(5-azanyl-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-5-chloranyl-phenyl]-phenyl-methanone chloride

Systemtic Name: [2-(5-azanyl-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-5-chloranyl-phenyl]-phenyl-methanone chloride Openeye Name: [2-(5-amino-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-5-chloro-phenyl]-phenyl-methanone chloride CAS Name: [2-(5-amino-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-5-chlorophenyl]-phenylmethanone chloride IUPAC Name: [2-(5-amino-3,4-dihydro-2H-pyrrol-1-ium-1-yl)-5-chlorophenyl]-phenylmethanone chloride Traditional Name: [2-(2-amino-1-pyrrolin-1-ium-1-yl)-5-chloro-phenyl]-phenyl-methanone chloride Formula: C17H16Cl2N2O MolecularWeight: 335.22774

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[N+](C1)C2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)N.[Cl-]

Isomeric SMILES

C1CC(=[N+](C1)C2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)N.[Cl-]

InChI

InChI=1S/C17H15ClN2O.ClH/c18-13-8-9-15(20-10-4-7-16(20)19)14(11-13)17(21)12-5-2-1-3-6-12;/h1-3,5-6,8-9,11,19H,4,7,10H2;1H