ethyl 2-[1-[(4-chloranyl-3-fluoranyl-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[1-[(4-chloranyl-3-fluoranyl-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: ethyl 2-[1-[(4-chloro-3-fluoro-phenyl)methyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(4-chloro-3-fluorophenyl)methyl]-3-oxo-2-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[(4-chloro-3-fluorophenyl)methyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(4-chloro-3-fluoro-benzyl)-3-keto-piperazin-2-yl]acetic acid ethyl ester Formula: C15H18ClFN2O3 MolecularWeight: 328.766423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)NCCN1CC2=CC(=C(C=C2)Cl)F

Isomeric SMILES

CCOC(=O)CC1C(=O)NCCN1CC2=CC(=C(C=C2)Cl)F

InChI

InChI=1S/C15H18ClFN2O3/c1-2-22-14(20)8-13-15(21)18-5-6-19(13)9-10-3-4-11(16)12(17)7-10/h3-4,7,13H,2,5-6,8-9H2,1H3,(H,18,21)