4-azanyl-6-methyl-3,4-dihydro-2H-thiochromene-7-carboxylic acid

Systemtic Name: 4-azanyl-6-methyl-3,4-dihydro-2H-thiochromene-7-carboxylic acid Openeye Name: 4-amino-6-methyl-thiochromane-7-carboxylic acid CAS Name: 4-amino-6-methyl-3,4-dihydro-2H-1-benzothiopyran-7-carboxylic acid IUPAC Name: 4-amino-6-methyl-3,4-dihydro-2H-thiochromene-7-carboxylic acid Traditional Name: 4-amino-6-methyl-thiochroman-7-carboxylic acid Formula: C11H13NO2S MolecularWeight: 223.29142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(=O)O)SCCC2N

Isomeric SMILES

CC1=CC2=C(C=C1C(=O)O)SCCC2N

InChI

InChI=1S/C11H13NO2S/c1-6-4-8-9(12)2-3-15-10(8)5-7(6)11(13)14/h4-5,9H,2-3,12H2,1H3,(H,13,14)