pyrazin-2-yl 4-butyl-3-(4-cyanophenyl)benzoate

Systemtic Name: pyrazin-2-yl 4-butyl-3-(4-cyanophenyl)benzoate Openeye Name: pyrazin-2-yl 4-butyl-3-(4-cyanophenyl)benzoate CAS Name: 4-butyl-3-(4-cyanophenyl)benzoic acid 2-pyrazinyl ester IUPAC Name: pyrazin-2-yl 4-butyl-3-(4-cyanophenyl)benzoate Traditional Name: 4-butyl-3-(4-cyanophenyl)benzoic acid pyrazin-2-yl ester Formula: C22H19N3O2 MolecularWeight: 357.40516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C=C1)C(=O)OC2=NC=CN=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCC1=C(C=C(C=C1)C(=O)OC2=NC=CN=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H19N3O2/c1-2-3-4-17-9-10-19(22(26)27-21-15-24-11-12-25-21)13-20(17)18-7-5-16(14-23)6-8-18/h5-13,15H,2-4H2,1H3