1-(2-methoxyphenyl)-4-nitro-butan-1-one

Systemtic Name: 1-(2-methoxyphenyl)-4-nitro-butan-1-one Openeye Name: 1-(2-methoxyphenyl)-4-nitro-butan-1-one CAS Name: 1-(2-methoxyphenyl)-4-nitro-1-butanone IUPAC Name: 1-(2-methoxyphenyl)-4-nitrobutan-1-one Traditional Name: 1-(2-methoxyphenyl)-4-nitro-butan-1-one Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)CCC[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1C(=O)CCC[N+](=O)[O-]

InChI

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