hexyl 2,3-dicyano-3-(4-dimethylaminophenyl)propanoate

Systemtic Name: hexyl 2,3-dicyano-3-(4-dimethylaminophenyl)propanoate Openeye Name: hexyl 2,3-dicyano-3-(4-dimethylaminophenyl)propanoate CAS Name: 2,3-dicyano-3-(4-dimethylaminophenyl)propanoic acid hexyl ester IUPAC Name: hexyl 2,3-dicyano-3-(4-dimethylaminophenyl)propanoate Traditional Name: 2,3-dicyano-3-(4-dimethylaminophenyl)propionic acid hexyl ester Formula: C19H25N3O2 MolecularWeight: 327.4207

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O2/c1-4-5-6-7-12-24-19(23)18(14-21)17(13-20)15-8-10-16(11-9-15)22(2)3/h8-11,17-18H,4-7,12H2,1-3H3