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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)NCC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)NCC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C21H26N2O4S/c1-27-21(24)19-9-5-18(6-10-19)16-28(25,26)22-15-17-7-11-20(12-8-17)23-13-3-2-4-14-23/h5-12,22H,2-4,13-16H2,1H3