2-[6,7-dimethoxy-2-[3-(4-methylphenyl)propanoyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanenitrile

Systemtic Name: 2-[6,7-dimethoxy-2-[3-(4-methylphenyl)propanoyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanenitrile Openeye Name: 2-[6,7-dimethoxy-2-[3-(p-tolyl)propanoyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetonitrile CAS Name: 2-[6,7-dimethoxy-2-[3-(4-methylphenyl)-1-oxopropyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetonitrile IUPAC Name: 2-[6,7-dimethoxy-2-[3-(4-methylphenyl)propanoyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetonitrile Traditional Name: 2-[6,7-dimethoxy-2-[3-(p-tolyl)propanoyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetonitrile Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(=O)N2CCC3=CC(=C(C=C3C2CC#N)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)CCC(=O)N2CCC3=CC(=C(C=C3C2CC#N)OC)OC

InChI

InChI=1S/C23H26N2O3/c1-16-4-6-17(7-5-16)8-9-23(26)25-13-11-18-14-21(27-2)22(28-3)15-19(18)20(25)10-12-24/h4-7,14-15,20H,8-11,13H2,1-3H3