4-[4-(4-methoxy-3-nitro-phenyl)-3H-1,3-thiazol-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-(4-methoxy-3-nitro-phenyl)-3H-1,3-thiazol-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-(4-methoxy-3-nitro-phenyl)-3H-thiazol-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[4-(4-methoxy-3-nitrophenyl)-3H-thiazol-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-(4-methoxy-3-nitrophenyl)-3H-1,3-thiazol-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[4-(4-methoxy-3-nitro-phenyl)-4-thiazolin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C16H12N2O4S MolecularWeight: 328.34248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=C3C=CC(=O)C=C3)N2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=C3C=CC(=O)C=C3)N2)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O4S/c1-22-15-7-4-11(8-14(15)18(20)21)13-9-23-16(17-13)10-2-5-12(19)6-3-10/h2-9,17H,1H3