13-(azepan-1-ylcarbonyl)-2,3-dimethoxy-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one

Systemtic Name: 13-(azepan-1-ylcarbonyl)-2,3-dimethoxy-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one Openeye Name: 13-(azepane-1-carbonyl)-2,3-dimethoxy-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one CAS Name: 13-[1-azepanyl(oxo)methyl]-2,3-dimethoxy-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one IUPAC Name: 13-(azepane-1-carbonyl)-2,3-dimethoxy-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one Traditional Name: 13-(azepane-1-carbonyl)-2,3-dimethoxy-5,6,13,13a-tetrahydroisoquinolin[2,1-b]isoquinolin-8-one Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C3C(C4=CC=CC=C4C(=O)N3CCC2=C1)C(=O)N5CCCCCC5)OC

Isomeric SMILES

COC1=C(C=C2C3C(C4=CC=CC=C4C(=O)N3CCC2=C1)C(=O)N5CCCCCC5)OC

InChI

InChI=1S/C26H30N2O4/c1-31-21-15-17-11-14-28-24(20(17)16-22(21)32-2)23(18-9-5-6-10-19(18)25(28)29)26(30)27-12-7-3-4-8-13-27/h5-6,9-10,15-16,23-24H,3-4,7-8,11-14H2,1-2H3