1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-4-(4-methoxyphenyl)piperazin-1-ium

Systemtic Name: 1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-4-(4-methoxyphenyl)piperazin-1-ium Openeye Name: 1-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidyl]-4-(4-methoxyphenyl)piperazin-1-ium CAS Name: 1-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidinyl]-4-(4-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-4-(4-methoxyphenyl)piperazin-1-ium Traditional Name: 1-[(3S)-1-(2-fluorobenzyl)-3-piperidyl]-4-(4-methoxyphenyl)piperazin-1-ium Formula: C23H31FN3O+ MolecularWeight: 384.510143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC[NH+](CC2)C3CCCN(C3)CC4=CC=CC=C4F

Isomeric SMILES

COC1=CC=C(C=C1)N2CC[NH+](CC2)[C@H]3CCCN(C3)CC4=CC=CC=C4F

InChI

InChI=1S/C23H30FN3O/c1-28-22-10-8-20(9-11-22)26-13-15-27(16-14-26)21-6-4-12-25(18-21)17-19-5-2-3-7-23(19)24/h2-3,5,7-11,21H,4,6,12-18H2,1H3/p+1/t21-/m0/s1