3-oxidanylidene-2-(phenylmethyl)-1H-isoindole-4-carboxylate

Systemtic Name: 3-oxidanylidene-2-(phenylmethyl)-1H-isoindole-4-carboxylate Openeye Name: 2-benzyl-3-oxo-isoindoline-4-carboxylate CAS Name: 3-oxo-2-(phenylmethyl)-1H-isoindole-4-carboxylate IUPAC Name: 2-benzyl-3-oxo-1H-isoindole-4-carboxylate Traditional Name: 2-benzyl-3-keto-isoindoline-4-carboxylate Formula: C16H12NO3- MolecularWeight: 266.27138

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC(=C2C(=O)N1CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

C1C2=CC=CC(=C2C(=O)N1CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C16H13NO3/c18-15-14-12(7-4-8-13(14)16(19)20)10-17(15)9-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,19,20)/p-1