(3-fluorophenyl)-[4-[4-(phenylmethyl)piperazin-1-ium-1-yl]piperidin-1-yl]methanone

Systemtic Name: (3-fluorophenyl)-[4-[4-(phenylmethyl)piperazin-1-ium-1-yl]piperidin-1-yl]methanone Openeye Name: [4-(4-benzylpiperazin-1-ium-1-yl)-1-piperidyl]-(3-fluorophenyl)methanone CAS Name: (3-fluorophenyl)-[4-[4-(phenylmethyl)-1-piperazin-1-iumyl]-1-piperidinyl]methanone IUPAC Name: [4-(4-benzylpiperazin-1-ium-1-yl)piperidin-1-yl]-(3-fluorophenyl)methanone Traditional Name: [4-(4-benzylpiperazin-1-ium-1-yl)piperidino]-(3-fluorophenyl)methanone Formula: C23H29FN3O+ MolecularWeight: 382.494263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CCN(CC2)CC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1CN(CCC1[NH+]2CCN(CC2)CC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C23H28FN3O/c24-21-8-4-7-20(17-21)23(28)27-11-9-22(10-12-27)26-15-13-25(14-16-26)18-19-5-2-1-3-6-19/h1-8,17,22H,9-16,18H2/p+1