N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]-2-(2-oxidanylideneazepan-1-yl)ethanamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]-2-(2-oxidanylideneazepan-1-yl)ethanamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]-2-(2-oxoazepan-1-yl)acetamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]-2-(2-oxo-1-azepanyl)acetamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]-2-(2-oxoazepan-1-yl)acetamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]-2-(2-ketoazepan-1-yl)acetamide Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)NC2=CC=CC=C2N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)NC2=CC=CC=C2N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H27N3O2/c27-22(17-26-14-7-1-2-12-23(26)28)24-20-10-5-6-11-21(20)25-15-13-18-8-3-4-9-19(18)16-25/h3-6,8-11H,1-2,7,12-17H2,(H,24,27)