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

Systemtic Name: 4-methyl-N-[4-(3-methylbutanoylamino)phenyl]-3-nitro-benzamide Openeye Name: 4-methyl-N-[4-(3-methylbutanoylamino)phenyl]-3-nitro-benzamide CAS Name: 4-methyl-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[4-(3-methylbutanoylamino)phenyl]-3-nitrobenzamide Traditional Name: N-[4-(isovalerylamino)phenyl]-4-methyl-3-nitro-benzamide Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)CC(C)C)[N+](=O)[O-]

InChI

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