3-azanylidene-2-(3,4-dimethylphenyl)-6,6-dimethyl-8-oxidanylidene-5,7-dihydroisoquinoline-4-carbonitrile

Systemtic Name: 3-azanylidene-2-(3,4-dimethylphenyl)-6,6-dimethyl-8-oxidanylidene-5,7-dihydroisoquinoline-4-carbonitrile Openeye Name: 2-(3,4-dimethylphenyl)-3-imino-6,6-dimethyl-8-oxo-5,7-dihydroisoquinoline-4-carbonitrile CAS Name: 2-(3,4-dimethylphenyl)-3-imino-6,6-dimethyl-8-oxo-5,7-dihydroisoquinoline-4-carbonitrile IUPAC Name: 2-(3,4-dimethylphenyl)-3-imino-6,6-dimethyl-8-oxo-5,7-dihydroisoquinoline-4-carbonitrile Traditional Name: 2-(3,4-dimethylphenyl)-3-imino-8-keto-6,6-dimethyl-5,7-dihydroisoquinoline-4-carbonitrile Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=C3C(=C(C2=N)C#N)CC(CC3=O)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=C3C(=C(C2=N)C#N)CC(CC3=O)(C)C)C

InChI

InChI=1S/C20H21N3O/c1-12-5-6-14(7-13(12)2)23-11-17-15(16(10-21)19(23)22)8-20(3,4)9-18(17)24/h5-7,11,22H,8-9H2,1-4H3