methyl 4-[methyl-[(4-piperidin-1-ylphenyl)methyl]sulfamoyl]benzoate

Systemtic Name: methyl 4-[methyl-[(4-piperidin-1-ylphenyl)methyl]sulfamoyl]benzoate Openeye Name: methyl 4-[methyl-[[4-(1-piperidyl)phenyl]methyl]sulfamoyl]benzoate CAS Name: 4-[methyl-[[4-(1-piperidinyl)phenyl]methyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[methyl-[(4-piperidin-1-ylphenyl)methyl]sulfamoyl]benzoate Traditional Name: 4-[methyl-(4-piperidinobenzyl)sulfamoyl]benzoic acid methyl ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)N2CCCCC2)S(=O)(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CN(CC1=CC=C(C=C1)N2CCCCC2)S(=O)(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H26N2O4S/c1-22(28(25,26)20-12-8-18(9-13-20)21(24)27-2)16-17-6-10-19(11-7-17)23-14-4-3-5-15-23/h6-13H,3-5,14-16H2,1-2H3