ethyl 4-[(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]benzoate

Systemtic Name: ethyl 4-[(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)sulfamoyl]benzoate Openeye Name: ethyl 4-[[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]sulfamoyl]benzoate CAS Name: 4-[[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)sulfamoyl]benzoate Traditional Name: 4-[(4-ethoxy-3-piperidinosulfonyl-phenyl)sulfamoyl]benzoic acid ethyl ester Formula: C22H28N2O7S2 MolecularWeight: 496.59692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)OCC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)OCC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H28N2O7S2/c1-3-30-20-13-10-18(16-21(20)33(28,29)24-14-6-5-7-15-24)23-32(26,27)19-11-8-17(9-12-19)22(25)31-4-2/h8-13,16,23H,3-7,14-15H2,1-2H3