N-[(2R)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-2-pyridin-3-yl-ethyl]-4-methoxy-benzamide

Systemtic Name: N-[(2R)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-2-pyridin-3-yl-ethyl]-4-methoxy-benzamide Openeye Name: N-[(2R)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-2-(3-pyridyl)ethyl]-4-methoxy-benzamide CAS Name: N-[(2R)-2-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]-2-(3-pyridinyl)ethyl]-4-methoxybenzamide IUPAC Name: N-[(2R)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-2-pyridin-3-ylethyl]-4-methoxybenzamide Traditional Name: N-[(2R)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-2-(3-pyridyl)ethyl]-4-methoxy-benzamide Formula: C25H28FN4O2+ MolecularWeight: 435.513823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCC(C2=CN=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC[C@@H](C2=CN=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C25H27FN4O2/c1-32-21-10-8-19(9-11-21)25(31)28-18-24(20-5-4-12-27-17-20)30-15-13-29(14-16-30)23-7-3-2-6-22(23)26/h2-12,17,24H,13-16,18H2,1H3,(H,28,31)/p+1/t24-/m0/s1