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

Systemtic Name: 2-[ethanoyl(methyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Openeye Name: 2-[acetyl(methyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid CAS Name: 2-[acetyl(methyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid IUPAC Name: 2-[acetyl(methyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Traditional Name: 2-[acetyl(methyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)C1=C(C2=C(S1)CCCC2)C(=O)O

Isomeric SMILES

CC(=O)N(C)C1=C(C2=C(S1)CCCC2)C(=O)O

InChI

InChI=1S/C12H15NO3S/c1-7(14)13(2)11-10(12(15)16)8-5-3-4-6-9(8)17-11/h3-6H2,1-2H3,(H,15,16)