methyl 4-[[1-[(4-fluorophenyl)methyl]piperidin-4-yl]methylsulfamoyl]-1-methyl-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[[1-[(4-fluorophenyl)methyl]piperidin-4-yl]methylsulfamoyl]-1-methyl-pyrrole-2-carboxylate Openeye Name: methyl 4-[[1-[(4-fluorophenyl)methyl]-4-piperidyl]methylsulfamoyl]-1-methyl-pyrrole-2-carboxylate CAS Name: 4-[[1-[(4-fluorophenyl)methyl]-4-piperidinyl]methylsulfamoyl]-1-methyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[[1-[(4-fluorophenyl)methyl]piperidin-4-yl]methylsulfamoyl]-1-methylpyrrole-2-carboxylate Traditional Name: 4-[[1-(4-fluorobenzyl)-4-piperidyl]methylsulfamoyl]-1-methyl-pyrrole-2-carboxylic acid methyl ester Formula: C20H26FN3O4S MolecularWeight: 423.501543

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OC)S(=O)(=O)NCC2CCN(CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CN1C=C(C=C1C(=O)OC)S(=O)(=O)NCC2CCN(CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C20H26FN3O4S/c1-23-14-18(11-19(23)20(25)28-2)29(26,27)22-12-15-7-9-24(10-8-15)13-16-3-5-17(21)6-4-16/h3-6,11,14-15,22H,7-10,12-13H2,1-2H3