[4-[[(4S)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]diazenyl]-2-oxidanyl-phenyl]arsonic acid

Systemtic Name: [4-[[(4S)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]diazenyl]-2-oxidanyl-phenyl]arsonic acid Openeye Name: [2-hydroxy-4-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]azo]phenyl]arsonic acid CAS Name: [2-hydroxy-4-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]azo]phenyl]arsonic acid IUPAC Name: [2-hydroxy-4-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]diazenyl]phenyl]arsonic acid Traditional Name: [2-hydroxy-4-[[(4S)-5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl]azo]phenyl]arsonic acid Formula: C16H15AsN4O5 MolecularWeight: 418.2357

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=CC(=C(C=C2)[As](=O)(O)O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)[C@H]1N=NC2=CC(=C(C=C2)[As](=O)(O)O)O)C3=CC=CC=C3

InChI

InChI=1S/C16H15AsN4O5/c1-10-15(16(23)21(20-10)12-5-3-2-4-6-12)19-18-11-7-8-13(14(22)9-11)17(24,25)26/h2-9,15,22H,1H3,(H2,24,25,26)/t15-/m0/s1