4-azanyl-3,4-dihydro-2H-thiochromene-7-carboxylic acid

Systemtic Name: 4-azanyl-3,4-dihydro-2H-thiochromene-7-carboxylic acid Openeye Name: 4-aminothiochromane-7-carboxylic acid CAS Name: 4-amino-3,4-dihydro-2H-1-benzothiopyran-7-carboxylic acid IUPAC Name: 4-amino-3,4-dihydro-2H-thiochromene-7-carboxylic acid Traditional Name: 4-aminothiochroman-7-carboxylic acid Formula: C10H11NO2S MolecularWeight: 209.26484

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1N)C=CC(=C2)C(=O)O

Isomeric SMILES

C1CSC2=C(C1N)C=CC(=C2)C(=O)O

InChI

InChI=1S/C10H11NO2S/c11-8-3-4-14-9-5-6(10(12)13)1-2-7(8)9/h1-2,5,8H,3-4,11H2,(H,12,13)