4-(4-methoxyphenyl)-3-nitro-but-3-en-2-one

Systemtic Name: 4-(4-methoxyphenyl)-3-nitro-but-3-en-2-one Openeye Name: 4-(4-methoxyphenyl)-3-nitro-but-3-en-2-one CAS Name: 4-(4-methoxyphenyl)-3-nitro-3-buten-2-one IUPAC Name: 4-(4-methoxyphenyl)-3-nitrobut-3-en-2-one Traditional Name: 4-(4-methoxyphenyl)-3-nitro-but-3-en-2-one Formula: C11H11NO4 MolecularWeight: 221.20934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=C(C=C1)OC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(=CC1=CC=C(C=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C11H11NO4/c1-8(13)11(12(14)15)7-9-3-5-10(16-2)6-4-9/h3-7H,1-2H3