N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-methyl-3-nitro-benzamide

Systemtic Name: N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-methyl-3-nitro-benzamide Openeye Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-methyl-3-nitro-benzamide CAS Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-methyl-3-nitrobenzamide IUPAC Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-methyl-3-nitrobenzamide Traditional Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-methyl-3-nitro-benzamide Formula: C19H19N3O4 MolecularWeight: 353.37186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC3=C(CCN(C3)C(=O)C)C=C2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC3=C(CCN(C3)C(=O)C)C=C2

InChI

InChI=1S/C19H19N3O4/c1-12-17(4-3-5-18(12)22(25)26)19(24)20-16-7-6-14-8-9-21(13(2)23)11-15(14)10-16/h3-7,10H,8-9,11H2,1-2H3,(H,20,24)