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

Systemtic Name: 3-[2-(azocan-1-yl)-2-oxidanylidene-ethyl]-4-[(4-chloranyl-3-fluoranyl-phenyl)methyl]piperazin-2-one Openeye Name: 3-[2-(azocan-1-yl)-2-oxo-ethyl]-4-[(4-chloro-3-fluoro-phenyl)methyl]piperazin-2-one CAS Name: 3-[2-(1-azocanyl)-2-oxoethyl]-4-[(4-chloro-3-fluorophenyl)methyl]-2-piperazinone IUPAC Name: 3-[2-(azocan-1-yl)-2-oxoethyl]-4-[(4-chloro-3-fluorophenyl)methyl]piperazin-2-one Traditional Name: 3-[2-(azocan-1-yl)-2-keto-ethyl]-4-(4-chloro-3-fluoro-benzyl)piperazin-2-one Formula: C20H27ClFN3O2 MolecularWeight: 395.898683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)CC2C(=O)NCCN2CC3=CC(=C(C=C3)Cl)F

Isomeric SMILES

C1CCCN(CCC1)C(=O)CC2C(=O)NCCN2CC3=CC(=C(C=C3)Cl)F

InChI

InChI=1S/C20H27ClFN3O2/c21-16-7-6-15(12-17(16)22)14-25-11-8-23-20(27)18(25)13-19(26)24-9-4-2-1-3-5-10-24/h6-7,12,18H,1-5,8-11,13-14H2,(H,23,27)