2-(2-methoxyphenyl)-1-[(2R)-4-methylsulfonyl-2-(pyrrolidin-1-ylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(2-methoxyphenyl)-1-[(2R)-4-methylsulfonyl-2-(pyrrolidin-1-ylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-(2-methoxyphenyl)-1-[(2R)-4-methylsulfonyl-2-(pyrrolidin-1-ylmethyl)piperazin-1-yl]ethanone CAS Name: 2-(2-methoxyphenyl)-1-[(2R)-4-methylsulfonyl-2-(1-pyrrolidinylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-(2-methoxyphenyl)-1-[(2R)-4-methylsulfonyl-2-(pyrrolidin-1-ylmethyl)piperazin-1-yl]ethanone Traditional Name: 1-[(2R)-4-mesyl-2-(pyrrolidinomethyl)piperazino]-2-(2-methoxyphenyl)ethanone Formula: C19H29N3O4S MolecularWeight: 395.51626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CC(=O)N2CCN(CC2CN3CCCC3)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC=C1CC(=O)N2CCN(C[C@H]2CN3CCCC3)S(=O)(=O)C

InChI

InChI=1S/C19H29N3O4S/c1-26-18-8-4-3-7-16(18)13-19(23)22-12-11-21(27(2,24)25)15-17(22)14-20-9-5-6-10-20/h3-4,7-8,17H,5-6,9-15H2,1-2H3/t17-/m1/s1