3-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-4-nitro-benzamide

Systemtic Name: 3-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-4-nitro-benzamide Openeye Name: 3-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-4-nitro-benzamide CAS Name: 3-methyl-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-4-nitrobenzamide Traditional Name: N-[3-(isobutyrylamino)benzyl]-3-methyl-4-nitro-benzamide Formula: C19H21N3O4 MolecularWeight: 355.38774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC2=CC(=CC=C2)NC(=O)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC2=CC(=CC=C2)NC(=O)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O4/c1-12(2)18(23)21-16-6-4-5-14(10-16)11-20-19(24)15-7-8-17(22(25)26)13(3)9-15/h4-10,12H,11H2,1-3H3,(H,20,24)(H,21,23)