2-[(2-methoxy-2-oxidanylidene-ethanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid

Systemtic Name: 2-[(2-methoxy-2-oxidanylidene-ethanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Openeye Name: 2-[(2-methoxy-2-oxo-acetyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid CAS Name: 2-[(2-methoxy-1,2-dioxoethyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid IUPAC Name: 2-[(2-methoxy-2-oxoacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Traditional Name: 2-(methoxalylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid Formula: C12H13NO5S MolecularWeight: 283.30032

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)O

Isomeric SMILES

COC(=O)C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)O

InChI

InChI=1S/C12H13NO5S/c1-18-12(17)9(14)13-10-8(11(15)16)6-4-2-3-5-7(6)19-10/h2-5H2,1H3,(H,13,14)(H,15,16)