[2-(12-prop-2-enoyloxydodecoxy)-6-propyl-phenyl] 2-pyrimidin-2-ylbenzoate

Systemtic Name: [2-(12-prop-2-enoyloxydodecoxy)-6-propyl-phenyl] 2-pyrimidin-2-ylbenzoate Openeye Name: [2-(12-prop-2-enoyloxydodecoxy)-6-propyl-phenyl] 2-pyrimidin-2-ylbenzoate CAS Name: 2-(2-pyrimidinyl)benzoic acid [2-[12-(1-oxoprop-2-enoxy)dodecoxy]-6-propylphenyl] ester IUPAC Name: [2-(12-prop-2-enoyloxydodecoxy)-6-propylphenyl] 2-pyrimidin-2-ylbenzoate Traditional Name: 2-(2-pyrimidyl)benzoic acid [2-(12-acryloyloxydodecoxy)-6-propyl-phenyl] ester Formula: C35H44N2O5 MolecularWeight: 572.73426

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC=C1)OCCCCCCCCCCCCOC(=O)C=C)OC(=O)C2=CC=CC=C2C3=NC=CC=N3

Isomeric SMILES

CCCC1=C(C(=CC=C1)OCCCCCCCCCCCCOC(=O)C=C)OC(=O)C2=CC=CC=C2C3=NC=CC=N3

InChI

InChI=1S/C35H44N2O5/c1-3-19-28-20-17-23-31(40-26-15-11-9-7-5-6-8-10-12-16-27-41-32(38)4-2)33(28)42-35(39)30-22-14-13-21-29(30)34-36-24-18-25-37-34/h4,13-14,17-18,20-25H,2-3,5-12,15-16,19,26-27H2,1H3