4-phenylbutyl (2S)-1-[(4-methoxyphenyl)-methyl-sulfamoyl]piperidine-2-carboxylate

Systemtic Name: 4-phenylbutyl (2S)-1-[(4-methoxyphenyl)-methyl-sulfamoyl]piperidine-2-carboxylate Openeye Name: 4-phenylbutyl (2S)-1-[(4-methoxyphenyl)-methyl-sulfamoyl]piperidine-2-carboxylate CAS Name: (2S)-1-[(4-methoxyphenyl)-methylsulfamoyl]-2-piperidinecarboxylic acid 4-phenylbutyl ester IUPAC Name: 4-phenylbutyl (2S)-1-[(4-methoxyphenyl)-methylsulfamoyl]piperidine-2-carboxylate Traditional Name: (2S)-1-[(4-methoxyphenyl)-methyl-sulfamoyl]pipecolinic acid 4-phenylbutyl ester Formula: C24H32N2O5S MolecularWeight: 460.58628

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OC)S(=O)(=O)N2CCCCC2C(=O)OCCCCC3=CC=CC=C3

Isomeric SMILES

CN(C1=CC=C(C=C1)OC)S(=O)(=O)N2CCCC[C@H]2C(=O)OCCCCC3=CC=CC=C3

InChI

InChI=1S/C24H32N2O5S/c1-25(21-14-16-22(30-2)17-15-21)32(28,29)26-18-8-6-13-23(26)24(27)31-19-9-7-12-20-10-4-3-5-11-20/h3-5,10-11,14-17,23H,6-9,12-13,18-19H2,1-2H3/t23-/m0/s1