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

Systemtic Name: 1-[(3S)-1-[(4-fluoranyl-2-methoxy-phenyl)methyl]piperidin-3-yl]-4-(2-methoxyphenyl)piperazin-1-ium Openeye Name: 1-[(3S)-1-[(4-fluoro-2-methoxy-phenyl)methyl]-3-piperidyl]-4-(2-methoxyphenyl)piperazin-1-ium CAS Name: 1-[(3S)-1-[(4-fluoro-2-methoxyphenyl)methyl]-3-piperidinyl]-4-(2-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-[(3S)-1-[(4-fluoro-2-methoxyphenyl)methyl]piperidin-3-yl]-4-(2-methoxyphenyl)piperazin-1-ium Traditional Name: 1-[(3S)-1-(4-fluoro-2-methoxy-benzyl)-3-piperidyl]-4-(2-methoxyphenyl)piperazin-1-ium Formula: C24H33FN3O2+ MolecularWeight: 414.536123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)C3CCCN(C3)CC4=C(C=C(C=C4)F)OC

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)[C@H]3CCCN(C3)CC4=C(C=C(C=C4)F)OC

InChI

InChI=1S/C24H32FN3O2/c1-29-23-8-4-3-7-22(23)28-14-12-27(13-15-28)21-6-5-11-26(18-21)17-19-9-10-20(25)16-24(19)30-2/h3-4,7-10,16,21H,5-6,11-15,17-18H2,1-2H3/p+1/t21-/m0/s1