N-[2-(azepan-1-yl)ethyl]-2-(2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)propanamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-2-(2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)propanamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)propanamide CAS Name: N-[2-(1-azepanyl)ethyl]-2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)propanamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)propanamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-2-(2-keto-4,5-dihydro-3H-1-benzazepin-1-yl)propionamide Formula: C21H31N3O2 MolecularWeight: 357.48974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCN1CCCCCC1)N2C(=O)CCCC3=CC=CC=C32

Isomeric SMILES

CC(C(=O)NCCN1CCCCCC1)N2C(=O)CCCC3=CC=CC=C32

InChI

InChI=1S/C21H31N3O2/c1-17(21(26)22-13-16-23-14-6-2-3-7-15-23)24-19-11-5-4-9-18(19)10-8-12-20(24)25/h4-5,9,11,17H,2-3,6-8,10,12-16H2,1H3,(H,22,26)