methyl 1-(4-methoxyphenyl)sulfonyl-2-(1-sulfanylethyl)piperidine-2-carboxylate

Systemtic Name: methyl 1-(4-methoxyphenyl)sulfonyl-2-(1-sulfanylethyl)piperidine-2-carboxylate Openeye Name: methyl 1-(4-methoxyphenyl)sulfonyl-2-(1-sulfanylethyl)piperidine-2-carboxylate CAS Name: 2-(1-mercaptoethyl)-1-(4-methoxyphenyl)sulfonyl-2-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-methoxyphenyl)sulfonyl-2-(1-sulfanylethyl)piperidine-2-carboxylate Traditional Name: 2-(1-mercaptoethyl)-1-(4-methoxyphenyl)sulfonyl-pipecolinic acid methyl ester Formula: C16H23NO5S2 MolecularWeight: 373.48752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1(CCCCN1S(=O)(=O)C2=CC=C(C=C2)OC)C(=O)OC)S

Isomeric SMILES

CC(C1(CCCCN1S(=O)(=O)C2=CC=C(C=C2)OC)C(=O)OC)S

InChI

InChI=1S/C16H23NO5S2/c1-12(23)16(15(18)22-3)10-4-5-11-17(16)24(19,20)14-8-6-13(21-2)7-9-14/h6-9,12,23H,4-5,10-11H2,1-3H3