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

Systemtic Name: (phenylmethyl) 4,5,6,7-tetrahydro-2H-isoindole-1-carboxylate Openeye Name: benzyl 4,5,6,7-tetrahydro-2H-isoindole-1-carboxylate CAS Name: 4,5,6,7-tetrahydro-2H-isoindole-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4,5,6,7-tetrahydro-2H-isoindole-1-carboxylate Traditional Name: 4,5,6,7-tetrahydro-2H-isoindole-1-carboxylic acid benzyl ester Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(NC=C2C1)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CCC2=C(NC=C2C1)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C16H17NO2/c18-16(19-11-12-6-2-1-3-7-12)15-14-9-5-4-8-13(14)10-17-15/h1-3,6-7,10,17H,4-5,8-9,11H2