(2E,6Z)-2-[(3-nitro-4-oxidanyl-phenyl)methylidene]-6-(thiophen-2-ylmethylidene)cyclohexan-1-one

Systemtic Name: (2E,6Z)-2-[(3-nitro-4-oxidanyl-phenyl)methylidene]-6-(thiophen-2-ylmethylidene)cyclohexan-1-one Openeye Name: (2E,6Z)-2-[(4-hydroxy-3-nitro-phenyl)methylene]-6-(2-thienylmethylene)cyclohexanone CAS Name: (2E,6Z)-2-[(4-hydroxy-3-nitrophenyl)methylidene]-6-(thiophen-2-ylmethylidene)-1-cyclohexanone IUPAC Name: (2E,6Z)-2-[(4-hydroxy-3-nitrophenyl)methylidene]-6-(thiophen-2-ylmethylidene)cyclohexan-1-one Traditional Name: (2E,6Z)-2-(4-hydroxy-3-nitro-benzylidene)-6-(2-thenylidene)cyclohexanone Formula: C18H15NO4S MolecularWeight: 341.381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC(=C(C=C2)O)[N+](=O)[O-])C(=O)C(=CC3=CC=CS3)C1

Isomeric SMILES

C1C/C(=C\C2=CC(=C(C=C2)O)[N+](=O)[O-])/C(=O)/C(=C\C3=CC=CS3)/C1

InChI

InChI=1S/C18H15NO4S/c20-17-7-6-12(10-16(17)19(22)23)9-13-3-1-4-14(18(13)21)11-15-5-2-8-24-15/h2,5-11,20H,1,3-4H2/b13-9+,14-11-