(4-cyanophenyl) 3-(3,4-dimethoxyphenyl)propanoate

Systemtic Name: (4-cyanophenyl) 3-(3,4-dimethoxyphenyl)propanoate Openeye Name: (4-cyanophenyl) 3-(3,4-dimethoxyphenyl)propanoate CAS Name: 3-(3,4-dimethoxyphenyl)propanoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-(3,4-dimethoxyphenyl)propanoate Traditional Name: 3-(3,4-dimethoxyphenyl)propionic acid (4-cyanophenyl) ester Formula: C18H17NO4 MolecularWeight: 311.33188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)OC2=CC=C(C=C2)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)OC2=CC=C(C=C2)C#N)OC

InChI

InChI=1S/C18H17NO4/c1-21-16-9-5-13(11-17(16)22-2)6-10-18(20)23-15-7-3-14(12-19)4-8-15/h3-5,7-9,11H,6,10H2,1-2H3