2-(2-dimethylaminoethyl)-6-methoxy-1-oxidanylidene-4-phenyl-isoquinoline-3-carbonitrile

Systemtic Name: 2-(2-dimethylaminoethyl)-6-methoxy-1-oxidanylidene-4-phenyl-isoquinoline-3-carbonitrile Openeye Name: 2-(2-dimethylaminoethyl)-6-methoxy-1-oxo-4-phenyl-isoquinoline-3-carbonitrile CAS Name: 2-(2-dimethylaminoethyl)-6-methoxy-1-oxo-4-phenyl-3-isoquinolinecarbonitrile IUPAC Name: 2-(2-dimethylaminoethyl)-6-methoxy-1-oxo-4-phenylisoquinoline-3-carbonitrile Traditional Name: 2-(2-dimethylaminoethyl)-1-keto-6-methoxy-4-phenyl-isoquinoline-3-carbonitrile Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(=C(C2=C(C1=O)C=CC(=C2)OC)C3=CC=CC=C3)C#N

Isomeric SMILES

CN(C)CCN1C(=C(C2=C(C1=O)C=CC(=C2)OC)C3=CC=CC=C3)C#N

InChI

InChI=1S/C21H21N3O2/c1-23(2)11-12-24-19(14-22)20(15-7-5-4-6-8-15)18-13-16(26-3)9-10-17(18)21(24)25/h4-10,13H,11-12H2,1-3H3