methyl 4-methyl-2-[[(2R)-1-(phenylsulfonyl)piperidin-2-yl]carbonyloxymethyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[[(2R)-1-(phenylsulfonyl)piperidin-2-yl]carbonyloxymethyl]quinoline-3-carboxylate Openeye Name: methyl 2-[[(2R)-1-(benzenesulfonyl)piperidine-2-carbonyl]oxymethyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[[(2R)-1-(benzenesulfonyl)-2-piperidinyl]-oxomethoxy]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(2R)-1-(benzenesulfonyl)piperidine-2-carbonyl]oxymethyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[(2R)-1-besylpipecoloyl]oxymethyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C25H26N2O6S MolecularWeight: 482.54874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)C3CCCCN3S(=O)(=O)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)[C@H]3CCCCN3S(=O)(=O)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C25H26N2O6S/c1-17-19-12-6-7-13-20(19)26-21(23(17)25(29)32-2)16-33-24(28)22-14-8-9-15-27(22)34(30,31)18-10-4-3-5-11-18/h3-7,10-13,22H,8-9,14-16H2,1-2H3/t22-/m1/s1