1-(2-methoxy-5-nitro-phenyl)pentan-3-one

Systemtic Name: 1-(2-methoxy-5-nitro-phenyl)pentan-3-one Openeye Name: 1-(2-methoxy-5-nitro-phenyl)pentan-3-one CAS Name: 1-(2-methoxy-5-nitrophenyl)-3-pentanone IUPAC Name: 1-(2-methoxy-5-nitrophenyl)pentan-3-one Traditional Name: 1-(2-methoxy-5-nitro-phenyl)pentan-3-one Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO4/c1-3-11(14)6-4-9-8-10(13(15)16)5-7-12(9)17-2/h5,7-8H,3-4,6H2,1-2H3