2-(dimethylamino)-N-[4-(3-methylbutanoylamino)phenyl]-5-nitro-benzamide

Systemtic Name: 2-(dimethylamino)-N-[4-(3-methylbutanoylamino)phenyl]-5-nitro-benzamide Openeye Name: 2-(dimethylamino)-N-[4-(3-methylbutanoylamino)phenyl]-5-nitro-benzamide CAS Name: 2-(dimethylamino)-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-5-nitrobenzamide IUPAC Name: 2-(dimethylamino)-N-[4-(3-methylbutanoylamino)phenyl]-5-nitrobenzamide Traditional Name: 2-(dimethylamino)-N-[4-(isovalerylamino)phenyl]-5-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=C(C=CC(=C2)[N+](=O)[O-])N(C)C

Isomeric SMILES

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

InChI

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