2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl 3-oxidanylnaphthalene-2-carboxylate

Systemtic Name: 2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl 3-oxidanylnaphthalene-2-carboxylate Openeye Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl 3-hydroxynaphthalene-2-carboxylate CAS Name: 3-hydroxy-2-naphthalenecarboxylic acid 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl ester IUPAC Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl 3-hydroxynaphthalene-2-carboxylate Traditional Name: 3-hydroxynaphthalene-2-carboxylic acid 2-(1,1,3-triketo-1,2-benzothiazol-2-yl)ethyl ester Formula: C20H15NO6S MolecularWeight: 397.4012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C(=CC2=C1)C(=O)OCCN3C(=O)C4=CC=CC=C4S3(=O)=O)O

Isomeric SMILES

C1=CC=C2C=C(C(=CC2=C1)C(=O)OCCN3C(=O)C4=CC=CC=C4S3(=O)=O)O

InChI

InChI=1S/C20H15NO6S/c22-17-12-14-6-2-1-5-13(14)11-16(17)20(24)27-10-9-21-19(23)15-7-3-4-8-18(15)28(21,25)26/h1-8,11-12,22H,9-10H2