3-(phenylsulfonyl)propyl 1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: 3-(phenylsulfonyl)propyl 1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: 3-(benzenesulfonyl)propyl 1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxylic acid 3-(benzenesulfonyl)propyl ester IUPAC Name: 3-(benzenesulfonyl)propyl 1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-mesitylsulfonylisonipecotic acid 3-besylpropyl ester Formula: C24H31NO6S2 MolecularWeight: 493.63604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)OCCCS(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)OCCCS(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C24H31NO6S2/c1-18-16-19(2)23(20(3)17-18)33(29,30)25-12-10-21(11-13-25)24(26)31-14-7-15-32(27,28)22-8-5-4-6-9-22/h4-6,8-9,16-17,21H,7,10-15H2,1-3H3