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

Systemtic Name: 2-[2-[2-(4-dimethylaminophenyl)ethanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]ethanenitrile Openeye Name: 2-[2-[2-(4-dimethylaminophenyl)acetyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetonitrile CAS Name: 2-[2-[2-(4-dimethylaminophenyl)-1-oxoethyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetonitrile IUPAC Name: 2-[2-[2-(4-dimethylaminophenyl)acetyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetonitrile Traditional Name: 2-[2-[2-(4-dimethylaminophenyl)acetyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetonitrile Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O3/c1-25(2)18-7-5-16(6-8-18)13-23(27)26-12-10-17-14-21(28-3)22(29-4)15-19(17)20(26)9-11-24/h5-8,14-15,20H,9-10,12-13H2,1-4H3