2-[2-[2-(propanoylamino)phenyl]carbonyloxyethanoylamino]-1,3-benzothiazole-6-carboxylic acid

Systemtic Name: 2-[2-[2-(propanoylamino)phenyl]carbonyloxyethanoylamino]-1,3-benzothiazole-6-carboxylic acid Openeye Name: 2-[[2-[2-(propanoylamino)benzoyl]oxyacetyl]amino]-1,3-benzothiazole-6-carboxylic acid CAS Name: 2-[[1-oxo-2-[oxo-[2-(1-oxopropylamino)phenyl]methoxy]ethyl]amino]-1,3-benzothiazole-6-carboxylic acid IUPAC Name: 2-[[2-[2-(propanoylamino)benzoyl]oxyacetyl]amino]-1,3-benzothiazole-6-carboxylic acid Traditional Name: 2-[[2-(2-propionamidobenzoyl)oxyacetyl]amino]-1,3-benzothiazole-6-carboxylic acid Formula: C20H17N3O6S MolecularWeight: 427.43048

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC=C1C(=O)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)O

Isomeric SMILES

CCC(=O)NC1=CC=CC=C1C(=O)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)O

InChI

InChI=1S/C20H17N3O6S/c1-2-16(24)21-13-6-4-3-5-12(13)19(28)29-10-17(25)23-20-22-14-8-7-11(18(26)27)9-15(14)30-20/h3-9H,2,10H2,1H3,(H,21,24)(H,26,27)(H,22,23,25)