4-phenylbutyl 1-(3,5-dimethoxyphenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: 4-phenylbutyl 1-(3,5-dimethoxyphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: 4-phenylbutyl 1-(3,5-dimethoxyphenyl)sulfonylpiperidine-2-carboxylate CAS Name: 1-(3,5-dimethoxyphenyl)sulfonyl-2-piperidinecarboxylic acid 4-phenylbutyl ester IUPAC Name: 4-phenylbutyl 1-(3,5-dimethoxyphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: 1-(3,5-dimethoxyphenyl)sulfonylpipecolinic acid 4-phenylbutyl ester Formula: C24H31NO6S MolecularWeight: 461.57104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)S(=O)(=O)N2CCCCC2C(=O)OCCCCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)S(=O)(=O)N2CCCCC2C(=O)OCCCCC3=CC=CC=C3)OC

InChI

InChI=1S/C24H31NO6S/c1-29-20-16-21(30-2)18-22(17-20)32(27,28)25-14-8-6-13-23(25)24(26)31-15-9-7-12-19-10-4-3-5-11-19/h3-5,10-11,16-18,23H,6-9,12-15H2,1-2H3