ethyl 1-[3-[(4-butylphenyl)sulfamoyl]-4-methyl-phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[(4-butylphenyl)sulfamoyl]-4-methyl-phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[3-[(4-butylphenyl)sulfamoyl]-4-methyl-benzoyl]piperidine-4-carboxylate CAS Name: 1-[[3-[(4-butylphenyl)sulfamoyl]-4-methylphenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(4-butylphenyl)sulfamoyl]-4-methylbenzoyl]piperidine-4-carboxylate Traditional Name: 1-[3-[(4-butylphenyl)sulfamoyl]-4-methyl-benzoyl]isonipecotic acid ethyl ester Formula: C26H34N2O5S MolecularWeight: 486.62356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCC(CC3)C(=O)OCC)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCC(CC3)C(=O)OCC)C

InChI

InChI=1S/C26H34N2O5S/c1-4-6-7-20-9-12-23(13-10-20)27-34(31,32)24-18-22(11-8-19(24)3)25(29)28-16-14-21(15-17-28)26(30)33-5-2/h8-13,18,21,27H,4-7,14-17H2,1-3H3