[6-[2-(4-cyanophenyl)ethyl]pyridin-3-yl] 4-propylbenzoate

Systemtic Name: [6-[2-(4-cyanophenyl)ethyl]pyridin-3-yl] 4-propylbenzoate Openeye Name: [6-[2-(4-cyanophenyl)ethyl]-3-pyridyl] 4-propylbenzoate CAS Name: 4-propylbenzoic acid [6-[2-(4-cyanophenyl)ethyl]-3-pyridinyl] ester IUPAC Name: [6-[2-(4-cyanophenyl)ethyl]pyridin-3-yl] 4-propylbenzoate Traditional Name: 4-propylbenzoic acid [6-[2-(4-cyanophenyl)ethyl]-3-pyridyl] ester Formula: C24H22N2O2 MolecularWeight: 370.44368

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)OC2=CN=C(C=C2)CCC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)OC2=CN=C(C=C2)CCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H22N2O2/c1-2-3-18-8-11-21(12-9-18)24(27)28-23-15-14-22(26-17-23)13-10-19-4-6-20(16-25)7-5-19/h4-9,11-12,14-15,17H,2-3,10,13H2,1H3