(3-oxidanylidenecyclohexen-1-yl) 2-chloranyl-4-(1,2,4-triazol-1-yl)benzoate

Systemtic Name: (3-oxidanylidenecyclohexen-1-yl) 2-chloranyl-4-(1,2,4-triazol-1-yl)benzoate Openeye Name: (3-oxocyclohexen-1-yl) 2-chloro-4-(1,2,4-triazol-1-yl)benzoate CAS Name: 2-chloro-4-(1,2,4-triazol-1-yl)benzoic acid (3-oxo-1-cyclohexenyl) ester IUPAC Name: (3-oxocyclohexen-1-yl) 2-chloro-4-(1,2,4-triazol-1-yl)benzoate Traditional Name: 2-chloro-4-(1,2,4-triazol-1-yl)benzoic acid (3-ketocyclohexen-1-yl) ester Formula: C15H12ClN3O3 MolecularWeight: 317.72708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=O)C1)OC(=O)C2=C(C=C(C=C2)N3C=NC=N3)Cl

Isomeric SMILES

C1CC(=CC(=O)C1)OC(=O)C2=C(C=C(C=C2)N3C=NC=N3)Cl

InChI

InChI=1S/C15H12ClN3O3/c16-14-6-10(19-9-17-8-18-19)4-5-13(14)15(21)22-12-3-1-2-11(20)7-12/h4-9H,1-3H2