[2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl] 2-azanyl-5-oxidanyl-benzoate

Systemtic Name: [2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl] 2-azanyl-5-oxidanyl-benzoate Openeye Name: [2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl] 2-amino-5-hydroxy-benzoate CAS Name: 2-amino-5-hydroxybenzoic acid [2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(6-nitro-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] 2-amino-5-hydroxybenzoate Traditional Name: 2-amino-5-hydroxy-benzoic acid [2-keto-2-[(6-nitro-1,3-benzothiazol-2-yl)amino]ethyl] ester Formula: C16H12N4O6S MolecularWeight: 388.35468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)COC(=O)C3=C(C=CC(=C3)O)N

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)COC(=O)C3=C(C=CC(=C3)O)N

InChI

InChI=1S/C16H12N4O6S/c17-11-3-2-9(21)6-10(11)15(23)26-7-14(22)19-16-18-12-4-1-8(20(24)25)5-13(12)27-16/h1-6,21H,7,17H2,(H,18,19,22)