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2-[[1-[3-[(2-ethoxyphenyl)amino]-3-oxidanylidene-propanoyl]-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]diazenyl]benzoic acid

2-[[1-[3-[(2-ethoxyphenyl)amino]-3-oxidanylidene-propanoyl]-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]diazenyl]benzoic acid

Systemtic Name:2-[[1-[3-[(2-ethoxyphenyl)amino]-3-oxidanylidene-propanoyl]-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]diazenyl]benzoic acid
Openeye Name:2-[[1-[3-(2-ethoxyanilino)-3-oxo-propanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]benzoic acid
CAS Name:2-[[1-[3-(2-ethoxyanilino)-1,3-dioxopropyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]azo]benzoic acid
IUPAC Name:2-[[1-[3-(2-ethoxyanilino)-3-oxopropanoyl]-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzoic acid
Traditional Name:2-[[5-keto-1-[3-keto-3-(o-phenetidino)propanoyl]-3-methyl-2-pyrazolin-4-yl]azo]benzoic acid
Formula: C22H21N5O6
MolecularWeight: 451.43204
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CC(=O)N2C(=O)C(C(=N2)C)N=NC3=CC=CC=C3C(=O)O


Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CC(=O)N2C(=O)C(C(=N2)C)N=NC3=CC=CC=C3C(=O)O


InChI

InChI=1S/C22H21N5O6/c1-3-33-17-11-7-6-10-16(17)23-18(28)12-19(29)27-21(30)20(13(2)26-27)25-24-15-9-5-4-8-14(15)22(31)32/h4-11,20H,3,12H2,1-2H3,(H,23,28)(H,31,32)


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