1-(3-methoxyphenyl)-4-nitro-butan-1-one

Systemtic Name: 1-(3-methoxyphenyl)-4-nitro-butan-1-one Openeye Name: 1-(3-methoxyphenyl)-4-nitro-butan-1-one CAS Name: 1-(3-methoxyphenyl)-4-nitro-1-butanone IUPAC Name: 1-(3-methoxyphenyl)-4-nitrobutan-1-one Traditional Name: 1-(3-methoxyphenyl)-4-nitro-butan-1-one Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)CCC[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)CCC[N+](=O)[O-]

InChI

InChI=1S/C11H13NO4/c1-16-10-5-2-4-9(8-10)11(13)6-3-7-12(14)15/h2,4-5,8H,3,6-7H2,1H3