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

Systemtic Name: N-[3-methyl-4-(2-phenylethanoylamino)phenyl]-4-nitro-benzamide Openeye Name: N-[3-methyl-4-[(2-phenylacetyl)amino]phenyl]-4-nitro-benzamide CAS Name: N-[3-methyl-4-[(1-oxo-2-phenylethyl)amino]phenyl]-4-nitrobenzamide IUPAC Name: N-[3-methyl-4-[(2-phenylacetyl)amino]phenyl]-4-nitrobenzamide Traditional Name: N-[3-methyl-4-[(2-phenylacetyl)amino]phenyl]-4-nitro-benzamide Formula: C22H19N3O4 MolecularWeight: 389.40396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19N3O4/c1-15-13-18(23-22(27)17-7-10-19(11-8-17)25(28)29)9-12-20(15)24-21(26)14-16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,23,27)(H,24,26)