[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] 3-oxidanylnaphthalene-2-carboxylate

Systemtic Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl] 3-oxidanylnaphthalene-2-carboxylate Openeye Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl] 3-hydroxynaphthalene-2-carboxylate CAS Name: 3-hydroxy-2-naphthalenecarboxylic acid [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl] 3-hydroxynaphthalene-2-carboxylate Traditional Name: 3-hydroxynaphthalene-2-carboxylic acid [2-keto-2-(piazthiol-4-ylamino)ethyl] ester Formula: C19H13N3O4S MolecularWeight: 379.38922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C(=CC2=C1)C(=O)OCC(=O)NC3=CC=CC4=NSN=C43)O

Isomeric SMILES

C1=CC=C2C=C(C(=CC2=C1)C(=O)OCC(=O)NC3=CC=CC4=NSN=C43)O

InChI

InChI=1S/C19H13N3O4S/c23-16-9-12-5-2-1-4-11(12)8-13(16)19(25)26-10-17(24)20-14-6-3-7-15-18(14)22-27-21-15/h1-9,23H,10H2,(H,20,24)