methyl 3-oxidanylidene-2-(phenylmethyl)-4,5,6,7-tetrahydro-1H-isoindole-5-carboxylate

Systemtic Name: methyl 3-oxidanylidene-2-(phenylmethyl)-4,5,6,7-tetrahydro-1H-isoindole-5-carboxylate Openeye Name: methyl 2-benzyl-3-oxo-4,5,6,7-tetrahydro-1H-isoindole-5-carboxylate CAS Name: 3-oxo-2-(phenylmethyl)-4,5,6,7-tetrahydro-1H-isoindole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-benzyl-3-oxo-4,5,6,7-tetrahydro-1H-isoindole-5-carboxylate Traditional Name: 2-benzyl-3-keto-4,5,6,7-tetrahydro-1H-isoindole-5-carboxylic acid methyl ester Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC2=C(C1)C(=O)N(C2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1CCC2=C(C1)C(=O)N(C2)CC3=CC=CC=C3

InChI

InChI=1S/C17H19NO3/c1-21-17(20)13-7-8-14-11-18(16(19)15(14)9-13)10-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3