2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)ethanamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-nitrophenyl)acetamide Formula: C17H17N3O3 MolecularWeight: 311.33518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O3/c21-17(18-15-6-3-7-16(10-15)20(22)23)12-19-9-8-13-4-1-2-5-14(13)11-19/h1-7,10H,8-9,11-12H2,(H,18,21)