6-azanyl-7,7-dicyano-2-methyl-8-(4-phenoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5-carboxamide

Systemtic Name: 6-azanyl-7,7-dicyano-2-methyl-8-(4-phenoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5-carboxamide Openeye Name: 6-amino-7,7-dicyano-2-methyl-8-(4-phenoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5-carboxamide CAS Name: 6-amino-7,7-dicyano-2-methyl-8-(4-phenoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5-carboxamide IUPAC Name: 6-amino-7,7-dicyano-2-methyl-8-(4-phenoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5-carboxamide Traditional Name: 6-amino-7,7-dicyano-2-methyl-8-(4-phenoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5-carboxamide Formula: C25H23N5O2 MolecularWeight: 425.48242

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC=C2C(C1)C(C(C(=C2C(=O)N)N)(C#N)C#N)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CN1CC=C2C(C1)C(C(C(=C2C(=O)N)N)(C#N)C#N)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H23N5O2/c1-30-12-11-19-20(13-30)22(25(14-26,15-27)23(28)21(19)24(29)31)16-7-9-18(10-8-16)32-17-5-3-2-4-6-17/h2-11,20,22H,12-13,28H2,1H3,(H2,29,31)