[2-[(3,5-diaminocarbonylphenyl)amino]-2-oxidanylidene-ethyl] 5-bromanyl-2-oxidanyl-benzoate

Systemtic Name: [2-[(3,5-diaminocarbonylphenyl)amino]-2-oxidanylidene-ethyl] 5-bromanyl-2-oxidanyl-benzoate Openeye Name: [2-(3,5-dicarbamoylanilino)-2-oxo-ethyl] 5-bromo-2-hydroxy-benzoate CAS Name: 5-bromo-2-hydroxybenzoic acid [2-(3,5-dicarbamoylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dicarbamoylanilino)-2-oxoethyl] 5-bromo-2-hydroxybenzoate Traditional Name: 5-bromo-2-hydroxy-benzoic acid [2-(3,5-dicarbamoylanilino)-2-keto-ethyl] ester Formula: C17H14BrN3O6 MolecularWeight: 436.21356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C(=O)OCC(=O)NC2=CC(=CC(=C2)C(=O)N)C(=O)N)O

Isomeric SMILES

C1=CC(=C(C=C1Br)C(=O)OCC(=O)NC2=CC(=CC(=C2)C(=O)N)C(=O)N)O

InChI

InChI=1S/C17H14BrN3O6/c18-10-1-2-13(22)12(6-10)17(26)27-7-14(23)21-11-4-8(15(19)24)3-9(5-11)16(20)25/h1-6,22H,7H2,(H2,19,24)(H2,20,25)(H,21,23)