[2-[4-(4-cyanophenyl)phenyl]pyrimidin-5-yl] heptanoate

Systemtic Name: [2-[4-(4-cyanophenyl)phenyl]pyrimidin-5-yl] heptanoate Openeye Name: [2-[4-(4-cyanophenyl)phenyl]pyrimidin-5-yl] heptanoate CAS Name: heptanoic acid [2-[4-(4-cyanophenyl)phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-[4-(4-cyanophenyl)phenyl]pyrimidin-5-yl] heptanoate Traditional Name: enanthic acid [2-[4-(4-cyanophenyl)phenyl]pyrimidin-5-yl] ester Formula: C24H23N3O2 MolecularWeight: 385.45832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H23N3O2/c1-2-3-4-5-6-23(28)29-22-16-26-24(27-17-22)21-13-11-20(12-14-21)19-9-7-18(15-25)8-10-19/h7-14,16-17H,2-6H2,1H3