[2-[4-(4-nonylphenyl)phenyl]pyrimidin-5-yl] octan-2-yl carbonate

Systemtic Name: [2-[4-(4-nonylphenyl)phenyl]pyrimidin-5-yl] octan-2-yl carbonate Openeye Name: 1-methylheptyl [2-[4-(4-nonylphenyl)phenyl]pyrimidin-5-yl] carbonate CAS Name: carbonic acid [2-[4-(4-nonylphenyl)phenyl]-5-pyrimidinyl] octan-2-yl ester IUPAC Name: [2-[4-(4-nonylphenyl)phenyl]pyrimidin-5-yl] octan-2-yl carbonate Traditional Name: carbonic acid 1-methylheptyl [2-[4-(4-nonylphenyl)phenyl]pyrimidin-5-yl] ester Formula: C34H46N2O3 MolecularWeight: 530.74064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)OC(=O)OC(C)CCCCCC

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC=C(C=N3)OC(=O)OC(C)CCCCCC

InChI

InChI=1S/C34H46N2O3/c1-4-6-8-10-11-12-14-16-28-17-19-29(20-18-28)30-21-23-31(24-22-30)33-35-25-32(26-36-33)39-34(37)38-27(3)15-13-9-7-5-2/h17-27H,4-16H2,1-3H3