4-(3-methoxy-5-nitro-phenyl)butan-2-one

Systemtic Name: 4-(3-methoxy-5-nitro-phenyl)butan-2-one Openeye Name: 4-(3-methoxy-5-nitro-phenyl)butan-2-one CAS Name: 4-(3-methoxy-5-nitrophenyl)-2-butanone IUPAC Name: 4-(3-methoxy-5-nitrophenyl)butan-2-one Traditional Name: 4-(3-methoxy-5-nitro-phenyl)butan-2-one Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC(=CC(=C1)OC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CCC1=CC(=CC(=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C11H13NO4/c1-8(13)3-4-9-5-10(12(14)15)7-11(6-9)16-2/h5-7H,3-4H2,1-2H3