(Z)-3-(2-nitrophenyl)sulfanyl-4-oxidanyl-hex-3-en-2-one

Systemtic Name: (Z)-3-(2-nitrophenyl)sulfanyl-4-oxidanyl-hex-3-en-2-one Openeye Name: (Z)-4-hydroxy-3-(2-nitrophenyl)sulfanyl-hex-3-en-2-one CAS Name: (Z)-4-hydroxy-3-[(2-nitrophenyl)thio]-3-hexen-2-one IUPAC Name: (Z)-4-hydroxy-3-(2-nitrophenyl)sulfanylhex-3-en-2-one Traditional Name: (Z)-4-hydroxy-3-[(2-nitrophenyl)thio]hex-3-en-2-one Formula: C12H13NO4S MolecularWeight: 267.30092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO4S/c1-3-10(15)12(8(2)14)18-11-7-5-4-6-9(11)13(16)17/h4-7,15H,3H2,1-2H3/b12-10-