(8aS)-6-azanylidene-8-(2,5-dimethylphenyl)-2-methyl-1,3,5,8a-tetrahydroisoquinoline-5,7-dicarbonitrile

Systemtic Name: (8aS)-6-azanylidene-8-(2,5-dimethylphenyl)-2-methyl-1,3,5,8a-tetrahydroisoquinoline-5,7-dicarbonitrile Openeye Name: (8aS)-8-(2,5-dimethylphenyl)-6-imino-2-methyl-1,3,5,8a-tetrahydroisoquinoline-5,7-dicarbonitrile CAS Name: (8aS)-8-(2,5-dimethylphenyl)-6-imino-2-methyl-1,3,5,8a-tetrahydroisoquinoline-5,7-dicarbonitrile IUPAC Name: (8aS)-8-(2,5-dimethylphenyl)-6-imino-2-methyl-1,3,5,8a-tetrahydroisoquinoline-5,7-dicarbonitrile Traditional Name: (8aS)-8-(2,5-dimethylphenyl)-6-imino-2-methyl-1,3,5,8a-tetrahydroisoquinoline-5,7-dicarbonitrile Formula: C20H20N4 MolecularWeight: 316.3996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=C(C(=N)C(C3=CCN(CC32)C)C#N)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=C(C(=N)C(C3=CCN(C[C@@H]32)C)C#N)C#N

InChI

InChI=1S/C20H20N4/c1-12-4-5-13(2)15(8-12)19-17(10-22)20(23)16(9-21)14-6-7-24(3)11-18(14)19/h4-6,8,16,18,23H,7,11H2,1-3H3/t16?,18-/m0/s1