4-(methylamino)-N-[4-(3-methylbutanoylamino)phenyl]-3-nitro-benzamide

Systemtic Name: 4-(methylamino)-N-[4-(3-methylbutanoylamino)phenyl]-3-nitro-benzamide Openeye Name: 4-(methylamino)-N-[4-(3-methylbutanoylamino)phenyl]-3-nitro-benzamide CAS Name: 4-(methylamino)-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-3-nitrobenzamide IUPAC Name: 4-(methylamino)-N-[4-(3-methylbutanoylamino)phenyl]-3-nitrobenzamide Traditional Name: N-[4-(isovalerylamino)phenyl]-4-(methylamino)-3-nitro-benzamide Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)NC)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)NC)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4/c1-12(2)10-18(24)21-14-5-7-15(8-6-14)22-19(25)13-4-9-16(20-3)17(11-13)23(26)27/h4-9,11-12,20H,10H2,1-3H3,(H,21,24)(H,22,25)