methyl 2-[(3-cyanophenyl)methyl]-3,4-dihydro-1H-isoquinoline-6-carboxylate

Systemtic Name: methyl 2-[(3-cyanophenyl)methyl]-3,4-dihydro-1H-isoquinoline-6-carboxylate Openeye Name: methyl 2-[(3-cyanophenyl)methyl]-3,4-dihydro-1H-isoquinoline-6-carboxylate CAS Name: 2-[(3-cyanophenyl)methyl]-3,4-dihydro-1H-isoquinoline-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(3-cyanophenyl)methyl]-3,4-dihydro-1H-isoquinoline-6-carboxylate Traditional Name: 2-(3-cyanobenzyl)-3,4-dihydro-1H-isoquinoline-6-carboxylic acid methyl ester Formula: C19H18N2O2 MolecularWeight: 306.35842

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(CN(CC2)CC3=CC=CC(=C3)C#N)C=C1

Isomeric SMILES

COC(=O)C1=CC2=C(CN(CC2)CC3=CC=CC(=C3)C#N)C=C1

InChI

InChI=1S/C19H18N2O2/c1-23-19(22)17-5-6-18-13-21(8-7-16(18)10-17)12-15-4-2-3-14(9-15)11-20/h2-6,9-10H,7-8,12-13H2,1H3