2-(ethylamino)-4-(4-oxidanylidene-1,3-benzothiazin-2-yl)benzoic acid

Systemtic Name: 2-(ethylamino)-4-(4-oxidanylidene-1,3-benzothiazin-2-yl)benzoic acid Openeye Name: 2-(ethylamino)-4-(4-oxo-1,3-benzothiazin-2-yl)benzoic acid CAS Name: 2-(ethylamino)-4-(4-oxo-1,3-benzothiazin-2-yl)benzoic acid IUPAC Name: 2-(ethylamino)-4-(4-oxo-1,3-benzothiazin-2-yl)benzoic acid Traditional Name: 2-(ethylamino)-4-(4-keto-1,3-benzothiazin-2-yl)benzoic acid Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=CC(=C1)C2=NC(=O)C3=CC=CC=C3S2)C(=O)O

Isomeric SMILES

CCNC1=C(C=CC(=C1)C2=NC(=O)C3=CC=CC=C3S2)C(=O)O

InChI

InChI=1S/C17H14N2O3S/c1-2-18-13-9-10(7-8-11(13)17(21)22)16-19-15(20)12-5-3-4-6-14(12)23-16/h3-9,18H,2H2,1H3,(H,21,22)