methyl 3-[2-(4-phenylpiperazin-1-yl)propylsulfamoyl]benzoate

Systemtic Name: methyl 3-[2-(4-phenylpiperazin-1-yl)propylsulfamoyl]benzoate Openeye Name: methyl 3-[2-(4-phenylpiperazin-1-yl)propylsulfamoyl]benzoate CAS Name: 3-[2-(4-phenyl-1-piperazinyl)propylsulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-(4-phenylpiperazin-1-yl)propylsulfamoyl]benzoate Traditional Name: 3-[2-(4-phenylpiperazino)propylsulfamoyl]benzoic acid methyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNS(=O)(=O)C1=CC=CC(=C1)C(=O)OC)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC(CNS(=O)(=O)C1=CC=CC(=C1)C(=O)OC)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O4S/c1-17(23-11-13-24(14-12-23)19-8-4-3-5-9-19)16-22-29(26,27)20-10-6-7-18(15-20)21(25)28-2/h3-10,15,17,22H,11-14,16H2,1-2H3