methyl (2R,4S)-1-[4-(4-methoxyphenyl)phenyl]sulfonyl-4-oxidanyl-piperidine-2-carboxylate

Systemtic Name: methyl (2R,4S)-1-[4-(4-methoxyphenyl)phenyl]sulfonyl-4-oxidanyl-piperidine-2-carboxylate Openeye Name: methyl (2R,4S)-4-hydroxy-1-[4-(4-methoxyphenyl)phenyl]sulfonyl-piperidine-2-carboxylate CAS Name: (2R,4S)-4-hydroxy-1-[4-(4-methoxyphenyl)phenyl]sulfonyl-2-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,4S)-4-hydroxy-1-[4-(4-methoxyphenyl)phenyl]sulfonylpiperidine-2-carboxylate Traditional Name: (2R,4S)-4-hydroxy-1-[4-(4-methoxyphenyl)phenyl]sulfonyl-pipecolinic acid methyl ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3C(=O)OC)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)N3CC[C@@H](C[C@@H]3C(=O)OC)O

InChI

InChI=1S/C20H23NO6S/c1-26-17-7-3-14(4-8-17)15-5-9-18(10-6-15)28(24,25)21-12-11-16(22)13-19(21)20(23)27-2/h3-10,16,19,22H,11-13H2,1-2H3/t16-,19+/m0/s1