1-(2-methyl-5-nitro-phenyl)propan-1-one

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)propan-1-one Openeye Name: 1-(2-methyl-5-nitro-phenyl)propan-1-one CAS Name: 1-(2-methyl-5-nitrophenyl)-1-propanone IUPAC Name: 1-(2-methyl-5-nitrophenyl)propan-1-one Traditional Name: 1-(2-methyl-5-nitro-phenyl)propan-1-one Formula: C10H11NO3 MolecularWeight: 193.19924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO3/c1-3-10(12)9-6-8(11(13)14)5-4-7(9)2/h4-6H,3H2,1-2H3