(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 1-(3-fluorophenyl)cyclopentane-1-carboxylate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 1-(3-fluorophenyl)cyclopentane-1-carboxylate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 1-(3-fluorophenyl)cyclopentanecarboxylate CAS Name: 1-(3-fluorophenyl)-1-cyclopentanecarboxylic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 1-(3-fluorophenyl)cyclopentane-1-carboxylate Traditional Name: 1-(3-fluorophenyl)cyclopentanecarboxylic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C20H18FN3O3 MolecularWeight: 367.373623

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC(=CC=C2)F)C(=O)OCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C1CCC(C1)(C2=CC(=CC=C2)F)C(=O)OCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H18FN3O3/c21-15-7-5-6-14(12-15)20(10-3-4-11-20)19(26)27-13-24-18(25)16-8-1-2-9-17(16)22-23-24/h1-2,5-9,12H,3-4,10-11,13H2