(3R)-4-[(2-methylphenyl)methyl]-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-2-one

Systemtic Name: (3R)-4-[(2-methylphenyl)methyl]-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-2-one Openeye Name: (3R)-4-(o-tolylmethyl)-3-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-2-one CAS Name: (3R)-4-[(2-methylphenyl)methyl]-3-[2-oxo-2-(1-pyrrolidinyl)ethyl]-2-piperazin-4-iumone IUPAC Name: (3R)-4-[(2-methylphenyl)methyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-2-one Traditional Name: (3R)-3-(2-keto-2-pyrrolidino-ethyl)-4-(2-methylbenzyl)piperazin-4-ium-2-one Formula: C18H26N3O2+ MolecularWeight: 316.41794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCNC(=O)C2CC(=O)N3CCCC3

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCNC(=O)[C@H]2CC(=O)N3CCCC3

InChI

InChI=1S/C18H25N3O2/c1-14-6-2-3-7-15(14)13-21-11-8-19-18(23)16(21)12-17(22)20-9-4-5-10-20/h2-3,6-7,16H,4-5,8-13H2,1H3,(H,19,23)/p+1/t16-/m1/s1