methyl 1-[4-[2-(2,6-dimethylphenoxy)ethanoylamino]phenyl]sulfonylpiperidine-3-carboxylate

Systemtic Name: methyl 1-[4-[2-(2,6-dimethylphenoxy)ethanoylamino]phenyl]sulfonylpiperidine-3-carboxylate Openeye Name: methyl 1-[4-[[2-(2,6-dimethylphenoxy)acetyl]amino]phenyl]sulfonylpiperidine-3-carboxylate CAS Name: 1-[4-[[2-(2,6-dimethylphenoxy)-1-oxoethyl]amino]phenyl]sulfonyl-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[[2-(2,6-dimethylphenoxy)acetyl]amino]phenyl]sulfonylpiperidine-3-carboxylate Traditional Name: 1-[4-[[2-(2,6-dimethylphenoxy)acetyl]amino]phenyl]sulfonylnipecotic acid methyl ester Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)OC

InChI

InChI=1S/C23H28N2O6S/c1-16-6-4-7-17(2)22(16)31-15-21(26)24-19-9-11-20(12-10-19)32(28,29)25-13-5-8-18(14-25)23(27)30-3/h4,6-7,9-12,18H,5,8,13-15H2,1-3H3,(H,24,26)