dimethyl 2-[[1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]carbonylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[1-(4-methoxyphenyl)sulfonylpiperidine-3-carbonyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[[1-(4-methoxyphenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[1-(4-methoxyphenyl)sulfonylpiperidine-3-carbonyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[1-(4-methoxyphenyl)sulfonylnipecotoyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C23H26N2O8S MolecularWeight: 490.52614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C23H26N2O8S/c1-31-17-7-9-18(10-8-17)34(29,30)25-12-4-5-16(14-25)21(26)24-20-13-15(22(27)32-2)6-11-19(20)23(28)33-3/h6-11,13,16H,4-5,12,14H2,1-3H3,(H,24,26)