(3-oxidanylidenecyclohexen-1-yl) 4-chloranyl-3-(4-methyl-5-oxidanylidene-1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: (3-oxidanylidenecyclohexen-1-yl) 4-chloranyl-3-(4-methyl-5-oxidanylidene-1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: (3-oxocyclohexen-1-yl) 4-chloro-3-(4-methyl-5-oxo-tetrazol-1-yl)benzoate CAS Name: 4-chloro-3-(4-methyl-5-oxo-1-tetrazolyl)benzoic acid (3-oxo-1-cyclohexenyl) ester IUPAC Name: (3-oxocyclohexen-1-yl) 4-chloro-3-(4-methyl-5-oxotetrazol-1-yl)benzoate Traditional Name: 4-chloro-3-(5-keto-4-methyl-tetrazol-1-yl)benzoic acid (3-ketocyclohexen-1-yl) ester Formula: C15H13ClN4O4 MolecularWeight: 348.74112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N(N=N1)C2=C(C=CC(=C2)C(=O)OC3=CC(=O)CCC3)Cl

Isomeric SMILES

CN1C(=O)N(N=N1)C2=C(C=CC(=C2)C(=O)OC3=CC(=O)CCC3)Cl

InChI

InChI=1S/C15H13ClN4O4/c1-19-15(23)20(18-17-19)13-7-9(5-6-12(13)16)14(22)24-11-4-2-3-10(21)8-11/h5-8H,2-4H2,1H3