4-(2-azanylethylamino)-N-(3-methylphenyl)-3-nitro-benzamide

Systemtic Name: 4-(2-azanylethylamino)-N-(3-methylphenyl)-3-nitro-benzamide Openeye Name: 4-(2-aminoethylamino)-N-(m-tolyl)-3-nitro-benzamide CAS Name: 4-(2-aminoethylamino)-N-(3-methylphenyl)-3-nitrobenzamide IUPAC Name: 4-(2-aminoethylamino)-N-(3-methylphenyl)-3-nitrobenzamide Traditional Name: 4-(2-aminoethylamino)-N-(m-tolyl)-3-nitro-benzamide Formula: C16H18N4O3 MolecularWeight: 314.33912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N4O3/c1-11-3-2-4-13(9-11)19-16(21)12-5-6-14(18-8-7-17)15(10-12)20(22)23/h2-6,9-10,18H,7-8,17H2,1H3,(H,19,21)