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

Systemtic Name: 3-methyl-N-[3-(3-methylbutanoylamino)-4-nitro-phenyl]butanamide Openeye Name: 3-methyl-N-[3-(3-methylbutanoylamino)-4-nitro-phenyl]butanamide CAS Name: 3-methyl-N-[3-[(3-methyl-1-oxobutyl)amino]-4-nitrophenyl]butanamide IUPAC Name: 3-methyl-N-[3-(3-methylbutanoylamino)-4-nitrophenyl]butanamide Traditional Name: N-[3-(isovalerylamino)-4-nitro-phenyl]-3-methyl-butyramide Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O4/c1-10(2)7-15(20)17-12-5-6-14(19(22)23)13(9-12)18-16(21)8-11(3)4/h5-6,9-11H,7-8H2,1-4H3,(H,17,20)(H,18,21)