2-[(4-cyclohexylsulfanylphenyl)sulfonylamino]ethanoic acid

Systemtic Name: 2-[(4-cyclohexylsulfanylphenyl)sulfonylamino]ethanoic acid Openeye Name: 2-[(4-cyclohexylsulfanylphenyl)sulfonylamino]acetic acid CAS Name: 2-[[4-(cyclohexylthio)phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[(4-cyclohexylsulfanylphenyl)sulfonylamino]acetic acid Traditional Name: 2-[[4-(cyclohexylthio)phenyl]sulfonylamino]acetic acid Formula: C14H19NO4S2 MolecularWeight: 329.43496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O

Isomeric SMILES

C1CCC(CC1)SC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C14H19NO4S2/c16-14(17)10-15-21(18,19)13-8-6-12(7-9-13)20-11-4-2-1-3-5-11/h6-9,11,15H,1-5,10H2,(H,16,17)