4-(cyclohexylsulfanylamino)benzene-1,3-dicarboxylic acid

Systemtic Name: 4-(cyclohexylsulfanylamino)benzene-1,3-dicarboxylic acid Openeye Name: 4-(cyclohexylsulfanylamino)benzene-1,3-dicarboxylic acid CAS Name: 4-[(cyclohexylthio)amino]benzene-1,3-dicarboxylic acid IUPAC Name: 4-(cyclohexylsulfanylamino)benzene-1,3-dicarboxylic acid Traditional Name: 4-[(cyclohexylthio)amino]isophthalic acid Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SNC2=C(C=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

C1CCC(CC1)SNC2=C(C=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C14H17NO4S/c16-13(17)9-6-7-12(11(8-9)14(18)19)15-20-10-4-2-1-3-5-10/h6-8,10,15H,1-5H2,(H,16,17)(H,18,19)