ethyl 4-[[1-(4-methylphenyl)sulfonylpiperidin-2-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[1-(4-methylphenyl)sulfonylpiperidin-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[1-(p-tolylsulfonyl)piperidine-2-carbonyl]amino]benzoate CAS Name: 4-[[[1-(4-methylphenyl)sulfonyl-2-piperidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[1-(4-methylphenyl)sulfonylpiperidine-2-carbonyl]amino]benzoate Traditional Name: 4-[(1-tosylpipecoloyl)amino]benzoic acid ethyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H26N2O5S/c1-3-29-22(26)17-9-11-18(12-10-17)23-21(25)20-6-4-5-15-24(20)30(27,28)19-13-7-16(2)8-14-19/h7-14,20H,3-6,15H2,1-2H3,(H,23,25)