N-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]-1-pyrrol-1-yl-cyclohexane-1-carboxamide

Systemtic Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]-1-pyrrol-1-yl-cyclohexane-1-carboxamide Openeye Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]-1-pyrrol-1-yl-cyclohexanecarboxamide CAS Name: N-[2-[4-(2-fluorophenyl)-1-piperazinyl]ethyl]-1-(1-pyrrolyl)-1-cyclohexanecarboxamide IUPAC Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]-1-pyrrol-1-ylcyclohexane-1-carboxamide Traditional Name: N-[2-[4-(2-fluorophenyl)piperazino]ethyl]-1-pyrrol-1-yl-cyclohexanecarboxamide Formula: C23H31FN4O MolecularWeight: 398.516843

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NCCN2CCN(CC2)C3=CC=CC=C3F)N4C=CC=C4

Isomeric SMILES

C1CCC(CC1)(C(=O)NCCN2CCN(CC2)C3=CC=CC=C3F)N4C=CC=C4

InChI

InChI=1S/C23H31FN4O/c24-20-8-2-3-9-21(20)27-18-16-26(17-19-27)15-12-25-22(29)23(10-4-1-5-11-23)28-13-6-7-14-28/h2-3,6-9,13-14H,1,4-5,10-12,15-19H2,(H,25,29)