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

Systemtic Name: (2-fluorophenyl)-[4-[1-(phenylmethyl)piperidin-1-ium-4-yl]piperazin-4-ium-1-yl]methanone Openeye Name: [4-(1-benzylpiperidin-1-ium-4-yl)piperazin-4-ium-1-yl]-(2-fluorophenyl)methanone CAS Name: (2-fluorophenyl)-[4-[1-(phenylmethyl)-4-piperidin-1-iumyl]-1-piperazin-4-iumyl]methanone IUPAC Name: [4-(1-benzylpiperidin-1-ium-4-yl)piperazin-4-ium-1-yl]-(2-fluorophenyl)methanone Traditional Name: [4-(1-benzylpiperidin-1-ium-4-yl)piperazin-4-ium-1-yl]-(2-fluorophenyl)methanone Formula: C23H30FN3O+2 MolecularWeight: 383.502203

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3F)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3F)CC4=CC=CC=C4

InChI

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