3-[[2-[2-(5-bromanyl-2-oxidanylidene-indol-3-yl)hydrazinyl]-2-oxidanylidene-ethanoyl]amino]benzoic acid

Systemtic Name: 3-[[2-[2-(5-bromanyl-2-oxidanylidene-indol-3-yl)hydrazinyl]-2-oxidanylidene-ethanoyl]amino]benzoic acid Openeye Name: 3-[[2-[2-(5-bromo-2-oxo-indol-3-yl)hydrazino]-2-oxo-acetyl]amino]benzoic acid CAS Name: 3-[[2-[(5-bromo-2-oxo-3-indolyl)hydrazo]-1,2-dioxoethyl]amino]benzoic acid IUPAC Name: 3-[[2-[2-(5-bromo-2-oxoindol-3-yl)hydrazinyl]-2-oxoacetyl]amino]benzoic acid Traditional Name: 3-[[2-[N'-(5-bromo-2-keto-indol-3-yl)hydrazino]-2-keto-acetyl]amino]benzoic acid Formula: C17H11BrN4O5 MolecularWeight: 431.19704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C(=O)NNC2=C3C=C(C=CC3=NC2=O)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C(=O)NNC2=C3C=C(C=CC3=NC2=O)Br)C(=O)O

InChI

InChI=1S/C17H11BrN4O5/c18-9-4-5-12-11(7-9)13(14(23)20-12)21-22-16(25)15(24)19-10-3-1-2-8(6-10)17(26)27/h1-7H,(H,19,24)(H,22,25)(H,26,27)(H,20,21,23)