4-[(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)ethanoyl]-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)ethanoyl]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetyl]-3-methoxy-benzonitrile CAS Name: 4-[(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-oxoethyl]-3-methoxybenzonitrile IUPAC Name: 4-[(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetyl]-3-methoxybenzonitrile Traditional Name: 4-[(2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)acetyl]-3-methoxy-benzonitrile Formula: C21H20N2O2 MolecularWeight: 332.3957

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=CC(=O)C3=C(C=C(C=C3)C#N)OC)N1)C

Isomeric SMILES

CC1(CC2=CC=CC=C2/C(=C/C(=O)C3=C(C=C(C=C3)C#N)OC)/N1)C

InChI

InChI=1S/C21H20N2O2/c1-21(2)12-15-6-4-5-7-16(15)18(23-21)11-19(24)17-9-8-14(13-22)10-20(17)25-3/h4-11,23H,12H2,1-3H3/b18-11-