4-[(E)-[[3-cyano-4-(methoxymethyl)-6-methyl-pyridin-2-yl]hydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[(E)-[[3-cyano-4-(methoxymethyl)-6-methyl-pyridin-2-yl]hydrazinylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridyl]hydrazono]methyl]benzoic acid CAS Name: 4-[(E)-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridyl]hydrazono]methyl]benzoic acid Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)COC)C#N)NN=CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=NC(=C(C(=C1)COC)C#N)N/N=C/C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C17H16N4O3/c1-11-7-14(10-24-2)15(8-18)16(20-11)21-19-9-12-3-5-13(6-4-12)17(22)23/h3-7,9H,10H2,1-2H3,(H,20,21)(H,22,23)/b19-9+