3,3-dimethyl-N-(2-methyl-5-nitro-phenyl)butanamide

Systemtic Name: 3,3-dimethyl-N-(2-methyl-5-nitro-phenyl)butanamide Openeye Name: 3,3-dimethyl-N-(2-methyl-5-nitro-phenyl)butanamide CAS Name: 3,3-dimethyl-N-(2-methyl-5-nitrophenyl)butanamide IUPAC Name: 3,3-dimethyl-N-(2-methyl-5-nitrophenyl)butanamide Traditional Name: 3,3-dimethyl-N-(2-methyl-5-nitro-phenyl)butyramide Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O3/c1-9-5-6-10(15(17)18)7-11(9)14-12(16)8-13(2,3)4/h5-7H,8H2,1-4H3,(H,14,16)