4-[(4,5-dimethoxy-2-nitro-phenyl)amino]butan-2-one

Systemtic Name: 4-[(4,5-dimethoxy-2-nitro-phenyl)amino]butan-2-one Openeye Name: 4-(4,5-dimethoxy-2-nitro-anilino)butan-2-one CAS Name: 4-(4,5-dimethoxy-2-nitroanilino)-2-butanone IUPAC Name: 4-(4,5-dimethoxy-2-nitroanilino)butan-2-one Traditional Name: 4-(4,5-dimethoxy-2-nitro-anilino)butan-2-one Formula: C12H16N2O5 MolecularWeight: 268.26584

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCNC1=CC(=C(C=C1[N+](=O)[O-])OC)OC

Isomeric SMILES

CC(=O)CCNC1=CC(=C(C=C1[N+](=O)[O-])OC)OC

InChI

InChI=1S/C12H16N2O5/c1-8(15)4-5-13-9-6-11(18-2)12(19-3)7-10(9)14(16)17/h6-7,13H,4-5H2,1-3H3