2-[[3-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-bis(oxidanylidene)-3H-pyridin-5-yl]diazenyl]benzoic acid

Systemtic Name: 2-[[3-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-bis(oxidanylidene)-3H-pyridin-5-yl]diazenyl]benzoic acid Openeye Name: 2-[[3-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-3H-pyridin-5-yl]azo]benzoic acid CAS Name: 2-[[3-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-3H-pyridin-5-yl]azo]benzoic acid IUPAC Name: 2-[[3-cyano-1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-3H-pyridin-5-yl]diazenyl]benzoic acid Traditional Name: 2-[[3-cyano-1-(2-hydroxyethyl)-2,6-diketo-4-methyl-3H-pyridin-5-yl]azo]benzoic acid Formula: C16H14N4O5 MolecularWeight: 342.30616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=O)C1C#N)CCO)N=NC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=C(C(=O)N(C(=O)C1C#N)CCO)N=NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H14N4O5/c1-9-11(8-17)14(22)20(6-7-21)15(23)13(9)19-18-12-5-3-2-4-10(12)16(24)25/h2-5,11,21H,6-7H2,1H3,(H,24,25)