methyl 4,4-dicyano-3-phenyl-but-3-enoate

Systemtic Name: methyl 4,4-dicyano-3-phenyl-but-3-enoate Openeye Name: methyl 4,4-dicyano-3-phenyl-but-3-enoate CAS Name: 4,4-dicyano-3-phenyl-3-butenoic acid methyl ester IUPAC Name: methyl 4,4-dicyano-3-phenylbut-3-enoate Traditional Name: 4,4-dicyano-3-phenyl-but-3-enoic acid methyl ester Formula: C13H10N2O2 MolecularWeight: 226.2307

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N2O2/c1-17-13(16)7-12(11(8-14)9-15)10-5-3-2-4-6-10/h2-6H,7H2,1H3