4-(3-methoxy-4-oxidanyl-phenyl)-3-nitro-but-3-en-2-one

Systemtic Name: 4-(3-methoxy-4-oxidanyl-phenyl)-3-nitro-but-3-en-2-one Openeye Name: 4-(4-hydroxy-3-methoxy-phenyl)-3-nitro-but-3-en-2-one CAS Name: 4-(4-hydroxy-3-methoxyphenyl)-3-nitro-3-buten-2-one IUPAC Name: 4-(4-hydroxy-3-methoxyphenyl)-3-nitrobut-3-en-2-one Traditional Name: 4-(4-hydroxy-3-methoxy-phenyl)-3-nitro-but-3-en-2-one Formula: C11H11NO5 MolecularWeight: 237.20874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO5/c1-7(13)9(12(15)16)5-8-3-4-10(14)11(6-8)17-2/h3-6,14H,1-2H3