4-phenylbutyl 1-(2-methoxyphenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: 4-phenylbutyl 1-(2-methoxyphenyl)sulfonylpiperidine-2-carboxylate Openeye Name: 4-phenylbutyl 1-(2-methoxyphenyl)sulfonylpiperidine-2-carboxylate CAS Name: 1-(2-methoxyphenyl)sulfonyl-2-piperidinecarboxylic acid 4-phenylbutyl ester IUPAC Name: 4-phenylbutyl 1-(2-methoxyphenyl)sulfonylpiperidine-2-carboxylate Traditional Name: 1-(2-methoxyphenyl)sulfonylpipecolinic acid 4-phenylbutyl ester Formula: C23H29NO5S MolecularWeight: 431.54506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1S(=O)(=O)N2CCCCC2C(=O)OCCCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1S(=O)(=O)N2CCCCC2C(=O)OCCCCC3=CC=CC=C3

InChI

InChI=1S/C23H29NO5S/c1-28-21-15-5-6-16-22(21)30(26,27)24-17-9-7-14-20(24)23(25)29-18-10-8-13-19-11-3-2-4-12-19/h2-6,11-12,15-16,20H,7-10,13-14,17-18H2,1H3