ethyl 4-[3-[(2-ethoxyphenyl)carbamoyl]piperidin-1-yl]sulfonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[3-[(2-ethoxyphenyl)carbamoyl]piperidin-1-yl]sulfonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[[3-[(2-ethoxyphenyl)carbamoyl]-1-piperidyl]sulfonyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[[3-[(2-ethoxyanilino)-oxomethyl]-1-piperidinyl]sulfonyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(2-ethoxyphenyl)carbamoyl]piperidin-1-yl]sulfonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-4-[3-(o-phenetylcarbamoyl)piperidino]sulfonyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C23H31N3O6S MolecularWeight: 477.57374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=C(NC(=C3C(=O)OCC)C)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=C(NC(=C3C(=O)OCC)C)C

InChI

InChI=1S/C23H31N3O6S/c1-5-31-19-12-8-7-11-18(19)25-22(27)17-10-9-13-26(14-17)33(29,30)21-16(4)24-15(3)20(21)23(28)32-6-2/h7-8,11-12,17,24H,5-6,9-10,13-14H2,1-4H3,(H,25,27)