2-[(2-methoxyphenyl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid

Systemtic Name: 2-[(2-methoxyphenyl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Openeye Name: 2-[(2-methoxybenzoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid CAS Name: 2-[[(2-methoxyphenyl)-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid IUPAC Name: 2-[(2-methoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Traditional Name: 2-(o-anisoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)O

InChI

InChI=1S/C17H17NO4S/c1-22-12-8-4-2-6-10(12)15(19)18-16-14(17(20)21)11-7-3-5-9-13(11)23-16/h2,4,6,8H,3,5,7,9H2,1H3,(H,18,19)(H,20,21)