6-azanyl-8-(4-cyanophenyl)-2-methyl-5-nitro-1,3,8,8a-tetrahydroisoquinoline-7,7-dicarbonitrile

Systemtic Name: 6-azanyl-8-(4-cyanophenyl)-2-methyl-5-nitro-1,3,8,8a-tetrahydroisoquinoline-7,7-dicarbonitrile Openeye Name: 6-amino-8-(4-cyanophenyl)-2-methyl-5-nitro-1,3,8,8a-tetrahydroisoquinoline-7,7-dicarbonitrile CAS Name: 6-amino-8-(4-cyanophenyl)-2-methyl-5-nitro-1,3,8,8a-tetrahydroisoquinoline-7,7-dicarbonitrile IUPAC Name: 6-amino-8-(4-cyanophenyl)-2-methyl-5-nitro-1,3,8,8a-tetrahydroisoquinoline-7,7-dicarbonitrile Traditional Name: 6-amino-8-(4-cyanophenyl)-2-methyl-5-nitro-1,3,8,8a-tetrahydroisoquinoline-7,7-dicarbonitrile Formula: C19H16N6O2 MolecularWeight: 360.36934

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC=C2C(C1)C(C(C(=C2[N+](=O)[O-])N)(C#N)C#N)C3=CC=C(C=C3)C#N

Isomeric SMILES

CN1CC=C2C(C1)C(C(C(=C2[N+](=O)[O-])N)(C#N)C#N)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H16N6O2/c1-24-7-6-14-15(9-24)16(13-4-2-12(8-20)3-5-13)19(10-21,11-22)18(23)17(14)25(26)27/h2-6,15-16H,7,9,23H2,1H3