N-(1-cyanocycloheptyl)-2-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(1-cyanocycloheptyl)-2-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]ethanamide Openeye Name: N-(1-cyanocycloheptyl)-2-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-yl]acetamide CAS Name: N-(1-cyanocycloheptyl)-2-[4-[2-(4-fluorophenyl)-1-oxoethyl]-1-piperazinyl]acetamide IUPAC Name: N-(1-cyanocycloheptyl)-2-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-yl]acetamide Traditional Name: N-(1-cyanocycloheptyl)-2-[4-[2-(4-fluorophenyl)acetyl]piperazino]acetamide Formula: C22H29FN4O2 MolecularWeight: 400.489663

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C#N)NC(=O)CN2CCN(CC2)C(=O)CC3=CC=C(C=C3)F

Isomeric SMILES

C1CCCC(CC1)(C#N)NC(=O)CN2CCN(CC2)C(=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C22H29FN4O2/c23-19-7-5-18(6-8-19)15-21(29)27-13-11-26(12-14-27)16-20(28)25-22(17-24)9-3-1-2-4-10-22/h5-8H,1-4,9-16H2,(H,25,28)