6-[5-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[5-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[5-[2-(4-nitrophenyl)-2-oxo-ethyl]sulfanyl-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[5-[[2-(4-nitrophenyl)-2-oxoethyl]thio]-3H-1,3,4-oxadiazol-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[5-[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[5-[[2-keto-2-(4-nitrophenyl)ethyl]thio]-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C16H11N3O5S MolecularWeight: 357.34064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2NN=C(O2)SCC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C=C1

Isomeric SMILES

C1=CC(=C2NN=C(O2)SCC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C=C1

InChI

InChI=1S/C16H11N3O5S/c20-13-4-2-1-3-12(13)15-17-18-16(24-15)25-9-14(21)10-5-7-11(8-6-10)19(22)23/h1-8,17H,9H2