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

Systemtic Name: 13-(azepan-1-ylcarbonyl)-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one Openeye Name: 13-(azepane-1-carbonyl)-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one CAS Name: 13-[1-azepanyl(oxo)methyl]-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one IUPAC Name: 13-(azepane-1-carbonyl)-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinolin-8-one Traditional Name: 13-(azepane-1-carbonyl)-5,6,13,13a-tetrahydroisoquinolin[2,1-b]isoquinolin-8-one Formula: C24H26N2O2 MolecularWeight: 374.47544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2C3C4=CC=CC=C4CCN3C(=O)C5=CC=CC=C25

Isomeric SMILES

C1CCCN(CC1)C(=O)C2C3C4=CC=CC=C4CCN3C(=O)C5=CC=CC=C25

InChI

InChI=1S/C24H26N2O2/c27-23-20-12-6-5-11-19(20)21(24(28)25-14-7-1-2-8-15-25)22-18-10-4-3-9-17(18)13-16-26(22)23/h3-6,9-12,21-22H,1-2,7-8,13-16H2