2-benzamido-7-oxidanyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid

Systemtic Name: 2-benzamido-7-oxidanyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Openeye Name: 2-benzamido-7-hydroxy-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid CAS Name: 2-benzamido-7-hydroxy-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid IUPAC Name: 2-benzamido-7-hydroxy-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid Traditional Name: 2-benzamido-7-hydroxy-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3)C(=O)O)O

Isomeric SMILES

C1CC(C2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3)C(=O)O)O

InChI

InChI=1S/C16H15NO4S/c18-11-8-4-7-10-12(16(20)21)15(22-13(10)11)17-14(19)9-5-2-1-3-6-9/h1-3,5-6,11,18H,4,7-8H2,(H,17,19)(H,20,21)