2-(carboxyamino)-5-propan-2-ylsulfanyl-benzoic acid

Systemtic Name: 2-(carboxyamino)-5-propan-2-ylsulfanyl-benzoic acid Openeye Name: 2-(carboxyamino)-5-isopropylsulfanyl-benzoic acid CAS Name: 2-(carboxyamino)-5-(propan-2-ylthio)benzoic acid IUPAC Name: 2-(carboxyamino)-5-propan-2-ylsulfanylbenzoic acid Traditional Name: 2-(carboxyamino)-5-(isopropylthio)benzoic acid Formula: C11H13NO4S MolecularWeight: 255.29022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC(=C(C=C1)NC(=O)O)C(=O)O

Isomeric SMILES

CC(C)SC1=CC(=C(C=C1)NC(=O)O)C(=O)O

InChI

InChI=1S/C11H13NO4S/c1-6(2)17-7-3-4-9(12-11(15)16)8(5-7)10(13)14/h3-6,12H,1-2H3,(H,13,14)(H,15,16)