methyl 5-oxidanylidene-2-phenyl-1-(phenylmethylidene)-2H-pyrrol-1-ium-3-carboxylate

Systemtic Name: methyl 5-oxidanylidene-2-phenyl-1-(phenylmethylidene)-2H-pyrrol-1-ium-3-carboxylate Openeye Name: methyl 1-benzylidene-5-oxo-2-phenyl-2H-pyrrol-1-ium-3-carboxylate CAS Name: 5-oxo-2-phenyl-1-(phenylmethylene)-2H-pyrrol-1-ium-3-carboxylic acid methyl ester IUPAC Name: methyl 1-benzylidene-5-oxo-2-phenyl-2H-pyrrol-1-ium-3-carboxylate Traditional Name: 1-benzal-5-keto-2-phenyl-3-pyrrolin-1-ium-3-carboxylic acid methyl ester Formula: C19H16NO3+ MolecularWeight: 306.33524

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=O)[N+](=CC2=CC=CC=C2)C1C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=O)[N+](=CC2=CC=CC=C2)C1C3=CC=CC=C3

InChI

InChI=1S/C19H16NO3/c1-23-19(22)16-12-17(21)20(13-14-8-4-2-5-9-14)18(16)15-10-6-3-7-11-15/h2-13,18H,1H3/q+1