(6R)-1-(3-methoxyphenyl)-6-methyl-4-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]piperazin-2-one

Systemtic Name: (6R)-1-(3-methoxyphenyl)-6-methyl-4-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]piperazin-2-one Openeye Name: (6R)-4-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-1-(3-methoxyphenyl)-6-methyl-piperazin-2-one CAS Name: (6R)-1-(3-methoxyphenyl)-6-methyl-4-[(3R)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-2-piperazinone IUPAC Name: (6R)-4-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-1-(3-methoxyphenyl)-6-methylpiperazin-2-one Traditional Name: (6R)-4-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-1-(3-methoxyphenyl)-6-methyl-piperazin-2-one Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(=O)N1C2=CC(=CC=C2)OC)C3CC[NH+](C3)CC4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CN(CC(=O)N1C2=CC(=CC=C2)OC)[C@@H]3CC[NH+](C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H29N3O2/c1-18-14-25(17-23(27)26(18)20-9-6-10-22(13-20)28-2)21-11-12-24(16-21)15-19-7-4-3-5-8-19/h3-10,13,18,21H,11-12,14-17H2,1-2H3/p+1/t18-,21-/m1/s1