(2-phenyl-1,3-oxazol-4-yl)methyl 1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (2-phenyl-1,3-oxazol-4-yl)methyl 1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (2-phenyloxazol-4-yl)methyl 1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-4-piperidinecarboxylic acid (2-phenyl-4-oxazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-oxazol-4-yl)methyl 1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3,4-dimethylphenyl)sulfonylisonipecotic acid (2-phenyloxazol-4-yl)methyl ester Formula: C24H26N2O5S MolecularWeight: 454.53864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC3=COC(=N3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC3=COC(=N3)C4=CC=CC=C4)C

InChI

InChI=1S/C24H26N2O5S/c1-17-8-9-22(14-18(17)2)32(28,29)26-12-10-20(11-13-26)24(27)31-16-21-15-30-23(25-21)19-6-4-3-5-7-19/h3-9,14-15,20H,10-13,16H2,1-2H3