4-[2-(methoxycarbonylamino)-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 4-[2-(methoxycarbonylamino)-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 4-[2-(methoxycarbonylamino)-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 4-[[2-(methoxycarbonylamino)-2-oxoethyl]thio]benzoic acid IUPAC Name: 4-[2-(methoxycarbonylamino)-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 4-[[2-(carbomethoxyamino)-2-keto-ethyl]thio]benzoic acid Formula: C11H11NO5S MolecularWeight: 269.27374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=O)CSC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

COC(=O)NC(=O)CSC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C11H11NO5S/c1-17-11(16)12-9(13)6-18-8-4-2-7(3-5-8)10(14)15/h2-5H,6H2,1H3,(H,14,15)(H,12,13,16)