pyrimidin-5-yl 4-decyl-2-(4-heptylphenyl)benzoate

Systemtic Name: pyrimidin-5-yl 4-decyl-2-(4-heptylphenyl)benzoate Openeye Name: pyrimidin-5-yl 4-decyl-2-(4-heptylphenyl)benzoate CAS Name: 4-decyl-2-(4-heptylphenyl)benzoic acid 5-pyrimidinyl ester IUPAC Name: pyrimidin-5-yl 4-decyl-2-(4-heptylphenyl)benzoate Traditional Name: 4-decyl-2-(4-heptylphenyl)benzoic acid 5-pyrimidyl ester Formula: C34H46N2O2 MolecularWeight: 514.74124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC(=C(C=C1)C(=O)OC2=CN=CN=C2)C3=CC=C(C=C3)CCCCCCC

Isomeric SMILES

CCCCCCCCCCC1=CC(=C(C=C1)C(=O)OC2=CN=CN=C2)C3=CC=C(C=C3)CCCCCCC

InChI

InChI=1S/C34H46N2O2/c1-3-5-7-9-10-11-13-15-17-29-20-23-32(34(37)38-31-25-35-27-36-26-31)33(24-29)30-21-18-28(19-22-30)16-14-12-8-6-4-2/h18-27H,3-17H2,1-2H3