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

Systemtic Name: [2-ethyl-6-(12-prop-2-enoyloxydodecoxy)phenyl] 2-pyrimidin-2-ylbenzoate Openeye Name: [2-ethyl-6-(12-prop-2-enoyloxydodecoxy)phenyl] 2-pyrimidin-2-ylbenzoate CAS Name: 2-(2-pyrimidinyl)benzoic acid [2-ethyl-6-[12-(1-oxoprop-2-enoxy)dodecoxy]phenyl] ester IUPAC Name: [2-ethyl-6-(12-prop-2-enoyloxydodecoxy)phenyl] 2-pyrimidin-2-ylbenzoate Traditional Name: 2-(2-pyrimidyl)benzoic acid [2-(12-acryloyloxydodecoxy)-6-ethyl-phenyl] ester Formula: C34H42N2O5 MolecularWeight: 558.70768

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)OCCCCCCCCCCCCOC(=O)C=C)OC(=O)C2=CC=CC=C2C3=NC=CC=N3

Isomeric SMILES

CCC1=C(C(=CC=C1)OCCCCCCCCCCCCOC(=O)C=C)OC(=O)C2=CC=CC=C2C3=NC=CC=N3

InChI

InChI=1S/C34H42N2O5/c1-3-27-19-17-22-30(39-25-15-11-9-7-5-6-8-10-12-16-26-40-31(37)4-2)32(27)41-34(38)29-21-14-13-20-28(29)33-35-23-18-24-36-33/h4,13-14,17-24H,2-3,5-12,15-16,25-26H2,1H3