[4-cyano-2-[4-[5-(10-prop-2-enoyloxydecoxy)pyrimidin-2-yl]phenyl]carbonyloxy-phenyl] 4-[5-(10-prop-2-enoyloxydecoxy)pyrimidin-2-yl]benzoate

Systemtic Name: [4-cyano-2-[4-[5-(10-prop-2-enoyloxydecoxy)pyrimidin-2-yl]phenyl]carbonyloxy-phenyl] 4-[5-(10-prop-2-enoyloxydecoxy)pyrimidin-2-yl]benzoate Openeye Name: [4-cyano-2-[4-[5-(10-prop-2-enoyloxydecoxy)pyrimidin-2-yl]benzoyl]oxy-phenyl] 4-[5-(10-prop-2-enoyloxydecoxy)pyrimidin-2-yl]benzoate CAS Name: 4-[5-[10-(1-oxoprop-2-enoxy)decoxy]-2-pyrimidinyl]benzoic acid [4-cyano-2-[oxo-[4-[5-[10-(1-oxoprop-2-enoxy)decoxy]-2-pyrimidinyl]phenyl]methoxy]phenyl] ester IUPAC Name: [4-cyano-2-[4-[5-(10-prop-2-enoyloxydecoxy)pyrimidin-2-yl]benzoyl]oxyphenyl] 4-[5-(10-prop-2-enoyloxydecoxy)pyrimidin-2-yl]benzoate Traditional Name: 4-[5-(10-acryloyloxydecoxy)pyrimidin-2-yl]benzoic acid [2-[4-[5-(10-acryloyloxydecoxy)pyrimidin-2-yl]benzoyl]oxy-4-cyano-phenyl] ester Formula: C55H61N5O10 MolecularWeight: 952.10034

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)C#N)OC(=O)C4=CC=C(C=C4)C5=NC=C(C=N5)OCCCCCCCCCCOC(=O)C=C

Isomeric SMILES

C=CC(=O)OCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)C#N)OC(=O)C4=CC=C(C=C4)C5=NC=C(C=N5)OCCCCCCCCCCOC(=O)C=C

InChI

InChI=1S/C55H61N5O10/c1-3-50(61)67-33-19-15-11-7-5-9-13-17-31-65-46-37-57-52(58-38-46)42-22-26-44(27-23-42)54(63)69-48-30-21-41(36-56)35-49(48)70-55(64)45-28-24-43(25-29-45)53-59-39-47(40-60-53)66-32-18-14-10-6-8-12-16-20-34-68-51(62)4-2/h3-4,21-30,35,37-40H,1-2,5-20,31-34H2