3-methyl-N-[(3-methylbutanoylamino)-(3-nitrophenyl)methyl]butanamide

Systemtic Name: 3-methyl-N-[(3-methylbutanoylamino)-(3-nitrophenyl)methyl]butanamide Openeye Name: 3-methyl-N-[(3-methylbutanoylamino)-(3-nitrophenyl)methyl]butanamide CAS Name: 3-methyl-N-[[(3-methyl-1-oxobutyl)amino]-(3-nitrophenyl)methyl]butanamide IUPAC Name: 3-methyl-N-[(3-methylbutanoylamino)-(3-nitrophenyl)methyl]butanamide Traditional Name: N-[(isovalerylamino)-(3-nitrophenyl)methyl]-3-methyl-butyramide Formula: C17H25N3O4 MolecularWeight: 335.3981

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O4/c1-11(2)8-15(21)18-17(19-16(22)9-12(3)4)13-6-5-7-14(10-13)20(23)24/h5-7,10-12,17H,8-9H2,1-4H3,(H,18,21)(H,19,22)