ethyl 5-cyano-4-(2,2-dicyanoethenylamino)-2-oxidanyl-3-phenylmethoxy-benzoate

Systemtic Name: ethyl 5-cyano-4-(2,2-dicyanoethenylamino)-2-oxidanyl-3-phenylmethoxy-benzoate Openeye Name: ethyl 3-benzyloxy-5-cyano-4-(2,2-dicyanovinylamino)-2-hydroxy-benzoate CAS Name: 5-cyano-4-(2,2-dicyanoethenylamino)-2-hydroxy-3-phenylmethoxybenzoic acid ethyl ester IUPAC Name: ethyl 5-cyano-4-(2,2-dicyanoethenylamino)-2-hydroxy-3-phenylmethoxybenzoate Traditional Name: 3-benzoxy-5-cyano-4-(2,2-dicyanovinylamino)-2-hydroxy-benzoic acid ethyl ester Formula: C21H16N4O4 MolecularWeight: 388.37614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C(=C1)C#N)NC=C(C#N)C#N)OCC2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C(=C1)C#N)NC=C(C#N)C#N)OCC2=CC=CC=C2)O

InChI

InChI=1S/C21H16N4O4/c1-2-28-21(27)17-8-16(11-24)18(25-12-15(9-22)10-23)20(19(17)26)29-13-14-6-4-3-5-7-14/h3-8,12,25-26H,2,13H2,1H3