methyl 4-[(E)-(2-cyanoethanoylhydrazinylidene)methyl]benzoate

Systemtic Name: methyl 4-[(E)-(2-cyanoethanoylhydrazinylidene)methyl]benzoate Openeye Name: methyl 4-[(E)-[(2-cyanoacetyl)hydrazono]methyl]benzoate CAS Name: 4-[(E)-[(2-cyano-1-oxoethyl)hydrazinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-[(2-cyanoacetyl)hydrazinylidene]methyl]benzoate Traditional Name: 4-[(E)-[(2-cyanoacetyl)hydrazono]methyl]benzoic acid methyl ester Formula: C12H11N3O3 MolecularWeight: 245.23404

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=NNC(=O)CC#N

Isomeric SMILES

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

InChI

InChI=1S/C12H11N3O3/c1-18-12(17)10-4-2-9(3-5-10)8-14-15-11(16)6-7-13/h2-5,8H,6H2,1H3,(H,15,16)/b14-8+