methyl 4-[[(4-cyanophenyl)-imidazol-1-yl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[(4-cyanophenyl)-imidazol-1-yl-amino]methyl]benzoate Openeye Name: methyl 4-[(4-cyano-N-imidazol-1-yl-anilino)methyl]benzoate CAS Name: 4-[[4-cyano-N-(1-imidazolyl)anilino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-cyano-N-imidazol-1-ylanilino)methyl]benzoate Traditional Name: 4-[(4-cyano-N-imidazol-1-yl-anilino)methyl]benzoic acid methyl ester Formula: C19H16N4O2 MolecularWeight: 332.35594

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN(C2=CC=C(C=C2)C#N)N3C=CN=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN(C2=CC=C(C=C2)C#N)N3C=CN=C3

InChI

InChI=1S/C19H16N4O2/c1-25-19(24)17-6-2-16(3-7-17)13-23(22-11-10-21-14-22)18-8-4-15(12-20)5-9-18/h2-11,14H,13H2,1H3