2-(dimethylamino)benzoic acid; 3-methyl-1,3-benzothiazol-2-one

Systemtic Name: 2-(dimethylamino)benzoic acid; 3-methyl-1,3-benzothiazol-2-one Openeye Name: 2-(dimethylamino)benzoic acid; 3-methyl-1,3-benzothiazol-2-one CAS Name: 2-(dimethylamino)benzoic acid; 3-methyl-1,3-benzothiazol-2-one IUPAC Name: 2-(dimethylamino)benzoic acid; 3-methyl-1,3-benzothiazol-2-one Traditional Name: 2-(dimethylamino)benzoic acid; 3-methyl-1,3-benzothiazol-2-one Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=O.CN(C)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2SC1=O.CN(C)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C9H11NO2.C8H7NOS/c1-10(2)8-6-4-3-5-7(8)9(11)12;1-9-6-4-2-3-5-7(6)11-8(9)10/h3-6H,1-2H3,(H,11,12);2-5H,1H3