ethyl 4-[4-[(3-chloranyl-4-methyl-phenyl)carbamoyl]piperidin-1-yl]sulfonyl-1,2,5-trimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[4-[(3-chloranyl-4-methyl-phenyl)carbamoyl]piperidin-1-yl]sulfonyl-1,2,5-trimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-[[4-[(3-chloro-4-methyl-phenyl)carbamoyl]-1-piperidyl]sulfonyl]-1,2,5-trimethyl-pyrrole-3-carboxylate CAS Name: 4-[[4-[(3-chloro-4-methylanilino)-oxomethyl]-1-piperidinyl]sulfonyl]-1,2,5-trimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(3-chloro-4-methylphenyl)carbamoyl]piperidin-1-yl]sulfonyl-1,2,5-trimethylpyrrole-3-carboxylate Traditional Name: 4-[4-[(3-chloro-4-methyl-phenyl)carbamoyl]piperidino]sulfonyl-1,2,5-trimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H30ClN3O5S MolecularWeight: 496.0194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)C)Cl)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)C)Cl)C)C)C

InChI

InChI=1S/C23H30ClN3O5S/c1-6-32-23(29)20-15(3)26(5)16(4)21(20)33(30,31)27-11-9-17(10-12-27)22(28)25-18-8-7-14(2)19(24)13-18/h7-8,13,17H,6,9-12H2,1-5H3,(H,25,28)