[2-(cyclopentylamino)-1-(4-fluorophenyl)-2-oxidanylidene-ethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate

Systemtic Name: [2-(cyclopentylamino)-1-(4-fluorophenyl)-2-oxidanylidene-ethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate Openeye Name: [2-(cyclopentylamino)-1-(4-fluorophenyl)-2-oxo-ethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate CAS Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid [2-(cyclopentylamino)-1-(4-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(cyclopentylamino)-1-(4-fluorophenyl)-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid [2-(cyclopentylamino)-1-(4-fluorophenyl)-2-keto-ethyl] ester Formula: C22H22FNO5 MolecularWeight: 399.412183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C(C2=CC=C(C=C2)F)OC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCC(C1)NC(=O)C(C2=CC=C(C=C2)F)OC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H22FNO5/c23-16-8-5-14(6-9-16)20(21(25)24-17-3-1-2-4-17)29-22(26)15-7-10-18-19(13-15)28-12-11-27-18/h5-10,13,17,20H,1-4,11-12H2,(H,24,25)