ethyl (3R)-3-[(2-methylphenyl)methyl]-1-propylsulfonyl-piperidine-3-carboxylate

Systemtic Name: ethyl (3R)-3-[(2-methylphenyl)methyl]-1-propylsulfonyl-piperidine-3-carboxylate Openeye Name: ethyl (3R)-3-(o-tolylmethyl)-1-propylsulfonyl-piperidine-3-carboxylate CAS Name: (3R)-3-[(2-methylphenyl)methyl]-1-propylsulfonyl-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-3-[(2-methylphenyl)methyl]-1-propylsulfonylpiperidine-3-carboxylate Traditional Name: (3R)-3-(2-methylbenzyl)-1-propylsulfonyl-nipecotic acid ethyl ester Formula: C19H29NO4S MolecularWeight: 367.50286

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)(CC2=CC=CC=C2C)C(=O)OCC

Isomeric SMILES

CCCS(=O)(=O)N1CCC[C@](C1)(CC2=CC=CC=C2C)C(=O)OCC

InChI

InChI=1S/C19H29NO4S/c1-4-13-25(22,23)20-12-8-11-19(15-20,18(21)24-5-2)14-17-10-7-6-9-16(17)3/h6-7,9-10H,4-5,8,11-15H2,1-3H3/t19-/m1/s1