4-ethoxy-3-(2-nitrophenyl)sulfanyl-4-oxidanyl-but-3-en-2-one

Systemtic Name: 4-ethoxy-3-(2-nitrophenyl)sulfanyl-4-oxidanyl-but-3-en-2-one Openeye Name: 4-ethoxy-4-hydroxy-3-(2-nitrophenyl)sulfanyl-but-3-en-2-one CAS Name: 4-ethoxy-4-hydroxy-3-[(2-nitrophenyl)thio]-3-buten-2-one IUPAC Name: 4-ethoxy-4-hydroxy-3-(2-nitrophenyl)sulfanylbut-3-en-2-one Traditional Name: 4-ethoxy-4-hydroxy-3-[(2-nitrophenyl)thio]but-3-en-2-one Formula: C12H13NO5S MolecularWeight: 283.30032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)C)SC1=CC=CC=C1[N+](=O)[O-])O

Isomeric SMILES

CCOC(=C(C(=O)C)SC1=CC=CC=C1[N+](=O)[O-])O

InChI

InChI=1S/C12H13NO5S/c1-3-18-12(15)11(8(2)14)19-10-7-5-4-6-9(10)13(16)17/h4-7,15H,3H2,1-2H3