(Z,1E)-4-(4-nitrophenyl)-4-oxidanyl-1-(4-phenyl-1,3-dithiol-2-ylidene)but-3-en-2-one

Systemtic Name: (Z,1E)-4-(4-nitrophenyl)-4-oxidanyl-1-(4-phenyl-1,3-dithiol-2-ylidene)but-3-en-2-one Openeye Name: (Z,1E)-4-hydroxy-4-(4-nitrophenyl)-1-(4-phenyl-1,3-dithiol-2-ylidene)but-3-en-2-one CAS Name: (Z,1E)-4-hydroxy-4-(4-nitrophenyl)-1-(4-phenyl-1,3-dithiol-2-ylidene)-3-buten-2-one IUPAC Name: (Z,1E)-4-hydroxy-4-(4-nitrophenyl)-1-(4-phenyl-1,3-dithiol-2-ylidene)but-3-en-2-one Traditional Name: (Z,1E)-4-hydroxy-4-(4-nitrophenyl)-1-(4-phenyl-1,3-dithiol-2-ylidene)but-3-en-2-one Formula: C19H13NO4S2 MolecularWeight: 383.44082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=CC(=O)C=C(C3=CC=C(C=C3)[N+](=O)[O-])O)S2

Isomeric SMILES

C1=CC=C(C=C1)C2=CS/C(=C\C(=O)/C=C(/C3=CC=C(C=C3)[N+](=O)[O-])\O)/S2

InChI

InChI=1S/C19H13NO4S2/c21-16(10-17(22)13-6-8-15(9-7-13)20(23)24)11-19-25-12-18(26-19)14-4-2-1-3-5-14/h1-12,22H/b17-10-,19-11+