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

Systemtic Name: 4-(dimethylamino)-N-[4-(3-methylbutanoylamino)phenyl]-3-nitro-benzamide Openeye Name: 4-(dimethylamino)-N-[4-(3-methylbutanoylamino)phenyl]-3-nitro-benzamide CAS Name: 4-(dimethylamino)-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-3-nitrobenzamide IUPAC Name: 4-(dimethylamino)-N-[4-(3-methylbutanoylamino)phenyl]-3-nitrobenzamide Traditional Name: 4-(dimethylamino)-N-[4-(isovalerylamino)phenyl]-3-nitro-benzamide Formula: C20H24N4O4 MolecularWeight: 384.42896

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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)N(C)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O4/c1-13(2)11-19(25)21-15-6-8-16(9-7-15)22-20(26)14-5-10-17(23(3)4)18(12-14)24(27)28/h5-10,12-13H,11H2,1-4H3,(H,21,25)(H,22,26)