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

Systemtic Name: 2-[6,7-dimethoxy-2-[(E)-3-(4-methylphenyl)prop-2-enoyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanenitrile Openeye Name: 2-[6,7-dimethoxy-2-[(E)-3-(p-tolyl)prop-2-enoyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetonitrile CAS Name: 2-[6,7-dimethoxy-2-[(E)-3-(4-methylphenyl)-1-oxoprop-2-enyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetonitrile IUPAC Name: 2-[6,7-dimethoxy-2-[(E)-3-(4-methylphenyl)prop-2-enoyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetonitrile Traditional Name: 2-[6,7-dimethoxy-2-[(E)-3-(p-tolyl)acryloyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetonitrile Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N2O3/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/h4-9,14-15,20H,10-11,13H2,1-3H3/b9-8+