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

Systemtic Name: (3-oxidanylidenecyclohexen-1-yl) 2-[(4-cyclohexyl-5-oxidanylidene-1,2,3,4-tetrazol-1-yl)methyl]-4-fluoranyl-benzoate Openeye Name: (3-oxocyclohexen-1-yl) 2-[(4-cyclohexyl-5-oxo-tetrazol-1-yl)methyl]-4-fluoro-benzoate CAS Name: 2-[(4-cyclohexyl-5-oxo-1-tetrazolyl)methyl]-4-fluorobenzoic acid (3-oxo-1-cyclohexenyl) ester IUPAC Name: (3-oxocyclohexen-1-yl) 2-[(4-cyclohexyl-5-oxotetrazol-1-yl)methyl]-4-fluorobenzoate Traditional Name: 2-[(4-cyclohexyl-5-keto-tetrazol-1-yl)methyl]-4-fluoro-benzoic acid (3-ketocyclohexen-1-yl) ester Formula: C21H23FN4O4 MolecularWeight: 414.430123

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)N(N=N2)CC3=C(C=CC(=C3)F)C(=O)OC4=CC(=O)CCC4

Isomeric SMILES

C1CCC(CC1)N2C(=O)N(N=N2)CC3=C(C=CC(=C3)F)C(=O)OC4=CC(=O)CCC4

InChI

InChI=1S/C21H23FN4O4/c22-15-9-10-19(20(28)30-18-8-4-7-17(27)12-18)14(11-15)13-25-21(29)26(24-23-25)16-5-2-1-3-6-16/h9-12,16H,1-8,13H2