1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]ethanone

Systemtic Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]ethanone Openeye Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]ethanone CAS Name: 1-[4-(4-methoxyphenyl)-1-piperazinyl]-2-[(2R)-2-(1-methyl-2-pyrrolyl)-1-pyrrolidin-1-iumyl]ethanone IUPAC Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]ethanone Traditional Name: 1-[4-(4-methoxyphenyl)piperazino]-2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]ethanone Formula: C22H31N4O2+ MolecularWeight: 383.50714

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCC[NH+]2CC(=O)N3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C=CC=C1[C@H]2CCC[NH+]2CC(=O)N3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H30N4O2/c1-23-11-3-5-20(23)21-6-4-12-26(21)17-22(27)25-15-13-24(14-16-25)18-7-9-19(28-2)10-8-18/h3,5,7-11,21H,4,6,12-17H2,1-2H3/p+1/t21-/m1/s1