4-[(4-methoxy-5-methyl-2-nitro-phenyl)amino]butan-2-one

Systemtic Name: 4-[(4-methoxy-5-methyl-2-nitro-phenyl)amino]butan-2-one Openeye Name: 4-(4-methoxy-5-methyl-2-nitro-anilino)butan-2-one CAS Name: 4-(4-methoxy-5-methyl-2-nitroanilino)-2-butanone IUPAC Name: 4-(4-methoxy-5-methyl-2-nitroanilino)butan-2-one Traditional Name: 4-(4-methoxy-5-methyl-2-nitro-anilino)butan-2-one Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OC)[N+](=O)[O-])NCCC(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1OC)[N+](=O)[O-])NCCC(=O)C

InChI

InChI=1S/C12H16N2O4/c1-8-6-10(13-5-4-9(2)15)11(14(16)17)7-12(8)18-3/h6-7,13H,4-5H2,1-3H3