methyl 3-azanyl-2,4-dicyano-5,6-diphenyl-benzoate

Systemtic Name: methyl 3-azanyl-2,4-dicyano-5,6-diphenyl-benzoate Openeye Name: methyl 3-amino-2,4-dicyano-5,6-diphenyl-benzoate CAS Name: 3-amino-2,4-dicyano-5,6-diphenylbenzoic acid methyl ester IUPAC Name: methyl 3-amino-2,4-dicyano-5,6-diphenylbenzoate Traditional Name: 3-amino-2,4-dicyano-5,6-diphenyl-benzoic acid methyl ester Formula: C22H15N3O2 MolecularWeight: 353.3734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(C(=C1C#N)N)C#N)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C(=C(C(=C1C#N)N)C#N)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H15N3O2/c1-27-22(26)20-17(13-24)21(25)16(12-23)18(14-8-4-2-5-9-14)19(20)15-10-6-3-7-11-15/h2-11H,25H2,1H3