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

Systemtic Name: 4-[(4-chloranyl-3-fluoranyl-phenyl)methyl]-3-[2-(4-methoxypiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-2-one Openeye Name: 4-[(4-chloro-3-fluoro-phenyl)methyl]-3-[2-(4-methoxy-1-piperidyl)-2-oxo-ethyl]piperazin-2-one CAS Name: 4-[(4-chloro-3-fluorophenyl)methyl]-3-[2-(4-methoxy-1-piperidinyl)-2-oxoethyl]-2-piperazinone IUPAC Name: 4-[(4-chloro-3-fluorophenyl)methyl]-3-[2-(4-methoxypiperidin-1-yl)-2-oxoethyl]piperazin-2-one Traditional Name: 4-(4-chloro-3-fluoro-benzyl)-3-[2-keto-2-(4-methoxypiperidino)ethyl]piperazin-2-one Formula: C19H25ClFN3O3 MolecularWeight: 397.871503

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCN(CC1)C(=O)CC2C(=O)NCCN2CC3=CC(=C(C=C3)Cl)F

Isomeric SMILES

COC1CCN(CC1)C(=O)CC2C(=O)NCCN2CC3=CC(=C(C=C3)Cl)F

InChI

InChI=1S/C19H25ClFN3O3/c1-27-14-4-7-23(8-5-14)18(25)11-17-19(26)22-6-9-24(17)12-13-2-3-15(20)16(21)10-13/h2-3,10,14,17H,4-9,11-12H2,1H3,(H,22,26)