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

Systemtic Name: 2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[(2R)-2-(1-methyl-2-pyrrolyl)-1-pyrrolidin-1-iumyl]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[(2R)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-ium-1-yl]-1-(4-phenylpiperazino)ethanone Formula: C21H29N4O+ MolecularWeight: 353.48116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N4O/c1-22-11-5-9-19(22)20-10-6-12-25(20)17-21(26)24-15-13-23(14-16-24)18-7-3-2-4-8-18/h2-5,7-9,11,20H,6,10,12-17H2,1H3/p+1/t20-/m1/s1