ethyl 3,4-bis[[4-[5-(12-prop-2-enoyloxydodecoxy)pyrimidin-2-yl]phenyl]methoxy]benzoate

Systemtic Name: ethyl 3,4-bis[[4-[5-(12-prop-2-enoyloxydodecoxy)pyrimidin-2-yl]phenyl]methoxy]benzoate Openeye Name: ethyl 3,4-bis[[4-[5-(12-prop-2-enoyloxydodecoxy)pyrimidin-2-yl]phenyl]methoxy]benzoate CAS Name: 3,4-bis[[4-[5-[12-(1-oxoprop-2-enoxy)dodecoxy]-2-pyrimidinyl]phenyl]methoxy]benzoic acid ethyl ester IUPAC Name: ethyl 3,4-bis[[4-[5-(12-prop-2-enoyloxydodecoxy)pyrimidin-2-yl]phenyl]methoxy]benzoate Traditional Name: 3,4-bis[[4-[5-(12-acryloyloxydodecoxy)pyrimidin-2-yl]benzyl]oxy]benzoic acid ethyl ester Formula: C61H78N4O10 MolecularWeight: 1027.29282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)OCC2=CC=C(C=C2)C3=NC=C(C=N3)OCCCCCCCCCCCCOC(=O)C=C)OCC4=CC=C(C=C4)C5=NC=C(C=N5)OCCCCCCCCCCCCOC(=O)C=C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)OCC2=CC=C(C=C2)C3=NC=C(C=N3)OCCCCCCCCCCCCOC(=O)C=C)OCC4=CC=C(C=C4)C5=NC=C(C=N5)OCCCCCCCCCCCCOC(=O)C=C

InChI

InChI=1S/C61H78N4O10/c1-4-57(66)72-39-25-21-17-13-9-7-11-15-19-23-37-70-53-42-62-59(63-43-53)50-31-27-48(28-32-50)46-74-55-36-35-52(61(68)69-6-3)41-56(55)75-47-49-29-33-51(34-30-49)60-64-44-54(45-65-60)71-38-24-20-16-12-8-10-14-18-22-26-40-73-58(67)5-2/h4-5,27-36,41-45H,1-2,6-26,37-40,46-47H2,3H3