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

Systemtic Name: (3-oxidanylidenecyclohexen-1-yl) 4-chloranyl-2-[(4-ethyl-5-oxidanylidene-1,2,3,4-tetrazol-1-yl)methyl]benzoate Openeye Name: (3-oxocyclohexen-1-yl) 4-chloro-2-[(4-ethyl-5-oxo-tetrazol-1-yl)methyl]benzoate CAS Name: 4-chloro-2-[(4-ethyl-5-oxo-1-tetrazolyl)methyl]benzoic acid (3-oxo-1-cyclohexenyl) ester IUPAC Name: (3-oxocyclohexen-1-yl) 4-chloro-2-[(4-ethyl-5-oxotetrazol-1-yl)methyl]benzoate Traditional Name: 4-chloro-2-[(4-ethyl-5-keto-tetrazol-1-yl)methyl]benzoic acid (3-ketocyclohexen-1-yl) ester Formula: C17H17ClN4O4 MolecularWeight: 376.79428

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)N(N=N1)CC2=C(C=CC(=C2)Cl)C(=O)OC3=CC(=O)CCC3

Isomeric SMILES

CCN1C(=O)N(N=N1)CC2=C(C=CC(=C2)Cl)C(=O)OC3=CC(=O)CCC3

InChI

InChI=1S/C17H17ClN4O4/c1-2-21-17(25)22(20-19-21)10-11-8-12(18)6-7-15(11)16(24)26-14-5-3-4-13(23)9-14/h6-9H,2-5,10H2,1H3