[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl (2R)-1-(phenylsulfonyl)piperidine-2-carboxylate

Systemtic Name: [3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl (2R)-1-(phenylsulfonyl)piperidine-2-carboxylate Openeye Name: [3-(4-methoxyphenyl)isoxazol-5-yl]methyl (2R)-1-(benzenesulfonyl)piperidine-2-carboxylate CAS Name: (2R)-1-(benzenesulfonyl)-2-piperidinecarboxylic acid [3-(4-methoxyphenyl)-5-isoxazolyl]methyl ester IUPAC Name: [3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl (2R)-1-(benzenesulfonyl)piperidine-2-carboxylate Traditional Name: (2R)-1-besylpipecolinic acid [3-(4-methoxyphenyl)isoxazol-5-yl]methyl ester Formula: C23H24N2O6S MolecularWeight: 456.51146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=C2)COC(=O)C3CCCCN3S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=C2)COC(=O)[C@H]3CCCCN3S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H24N2O6S/c1-29-18-12-10-17(11-13-18)21-15-19(31-24-21)16-30-23(26)22-9-5-6-14-25(22)32(27,28)20-7-3-2-4-8-20/h2-4,7-8,10-13,15,22H,5-6,9,14,16H2,1H3/t22-/m1/s1