2-(3,4-dihydro-2H-thiochromen-2-ylcarbonylamino)benzoic acid

Systemtic Name: 2-(3,4-dihydro-2H-thiochromen-2-ylcarbonylamino)benzoic acid Openeye Name: 2-(thiochromane-2-carbonylamino)benzoic acid CAS Name: 2-[[3,4-dihydro-2H-1-benzothiopyran-2-yl(oxo)methyl]amino]benzoic acid IUPAC Name: 2-(3,4-dihydro-2H-thiochromene-2-carbonylamino)benzoic acid Traditional Name: 2-(thiochroman-2-carbonylamino)benzoic acid Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2SC1C(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CC2=CC=CC=C2SC1C(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C17H15NO3S/c19-16(18-13-7-3-2-6-12(13)17(20)21)15-10-9-11-5-1-4-8-14(11)22-15/h1-8,15H,9-10H2,(H,18,19)(H,20,21)