N-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethylamino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethylamino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethylamino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethylamino]-2-keto-ethyl]-3-nitro-benzamide Formula: C20H22N4O4 MolecularWeight: 382.41308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O4/c25-19(13-22-20(26)16-6-3-7-18(12-16)24(27)28)21-9-11-23-10-8-15-4-1-2-5-17(15)14-23/h1-7,12H,8-11,13-14H2,(H,21,25)(H,22,26)