[4-chloranyl-2-(phenylmethyl)phenyl] 1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxylate

Systemtic Name: [4-chloranyl-2-(phenylmethyl)phenyl] 1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxylate Openeye Name: (2-benzyl-4-chloro-phenyl) 1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxylate CAS Name: 1-methyl-4-(4-morpholinylsulfonyl)-2-pyrrolecarboxylic acid [4-chloro-2-(phenylmethyl)phenyl] ester IUPAC Name: (2-benzyl-4-chlorophenyl) 1-methyl-4-morpholin-4-ylsulfonylpyrrole-2-carboxylate Traditional Name: 1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxylic acid (2-benzyl-4-chloro-phenyl) ester Formula: C23H23ClN2O5S MolecularWeight: 474.95712

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OC2=C(C=C(C=C2)Cl)CC3=CC=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)OC2=C(C=C(C=C2)Cl)CC3=CC=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H23ClN2O5S/c1-25-16-20(32(28,29)26-9-11-30-12-10-26)15-21(25)23(27)31-22-8-7-19(24)14-18(22)13-17-5-3-2-4-6-17/h2-8,14-16H,9-13H2,1H3