methyl 2-(phenylmethyl)-1,3,4,5,6,7-hexahydroisoindole-5-carboxylate

Systemtic Name: methyl 2-(phenylmethyl)-1,3,4,5,6,7-hexahydroisoindole-5-carboxylate Openeye Name: methyl 2-benzyl-1,3,4,5,6,7-hexahydroisoindole-5-carboxylate CAS Name: 2-(phenylmethyl)-1,3,4,5,6,7-hexahydroisoindole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-benzyl-1,3,4,5,6,7-hexahydroisoindole-5-carboxylate Traditional Name: 2-benzyl-1,3,4,5,6,7-hexahydroisoindole-5-carboxylic acid methyl ester Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO2/c1-20-17(19)14-7-8-15-11-18(12-16(15)9-14)10-13-5-3-2-4-6-13/h2-6,14H,7-12H2,1H3