N-(3-cyanophenyl)-2,3-diethoxy-8-oxidanylidene-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide

Systemtic Name: N-(3-cyanophenyl)-2,3-diethoxy-8-oxidanylidene-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide Openeye Name: N-(3-cyanophenyl)-2,3-diethoxy-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide CAS Name: N-(3-cyanophenyl)-2,3-diethoxy-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide IUPAC Name: N-(3-cyanophenyl)-2,3-diethoxy-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide Traditional Name: N-(3-cyanophenyl)-2,3-diethoxy-8-keto-5,6,13,13a-tetrahydroisoquinolin[2,1-b]isoquinoline-13-carboxamide Formula: C29H27N3O4 MolecularWeight: 481.54238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C3C(C4=CC=CC=C4C(=O)N3CCC2=C1)C(=O)NC5=CC=CC(=C5)C#N)OCC

Isomeric SMILES

CCOC1=C(C=C2C3C(C4=CC=CC=C4C(=O)N3CCC2=C1)C(=O)NC5=CC=CC(=C5)C#N)OCC

InChI

InChI=1S/C29H27N3O4/c1-3-35-24-15-19-12-13-32-27(23(19)16-25(24)36-4-2)26(21-10-5-6-11-22(21)29(32)34)28(33)31-20-9-7-8-18(14-20)17-30/h5-11,14-16,26-27H,3-4,12-13H2,1-2H3,(H,31,33)