1-[2-oxidanylidene-2-[[4-(phenylsulfamoyl)phenyl]amino]ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-[[4-(phenylsulfamoyl)phenyl]amino]ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-oxo-2-[4-(phenylsulfamoyl)anilino]ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-oxo-2-[4-(phenylsulfamoyl)anilino]ethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-oxo-2-[4-(phenylsulfamoyl)anilino]ethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-keto-2-[4-(phenylsulfamoyl)anilino]ethyl]cycloheptanecarboxylic acid Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CCCC(CC1)(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H26N2O5S/c25-20(16-22(21(26)27)14-6-1-2-7-15-22)23-17-10-12-19(13-11-17)30(28,29)24-18-8-4-3-5-9-18/h3-5,8-13,24H,1-2,6-7,14-16H2,(H,23,25)(H,26,27)