3-phenylpropyl 2-[1-(2-fluorophenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 3-phenylpropyl 2-[1-(2-fluorophenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: 3-phenylpropyl 2-[1-(2-fluorobenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(2-fluorophenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 2-[1-(2-fluorobenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(2-fluorobenzoyl)-3-keto-piperazin-2-yl]acetic acid 3-phenylpropyl ester Formula: C22H23FN2O4 MolecularWeight: 398.427423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)OCCCC2=CC=CC=C2)C(=O)C3=CC=CC=C3F

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)OCCCC2=CC=CC=C2)C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H23FN2O4/c23-18-11-5-4-10-17(18)22(28)25-13-12-24-21(27)19(25)15-20(26)29-14-6-9-16-7-2-1-3-8-16/h1-5,7-8,10-11,19H,6,9,12-15H2,(H,24,27)