propyl 3,4-bis[[4-[5-(8-prop-2-enoyloxyoctoxy)pyrimidin-2-yl]phenyl]carbonyloxy]benzoate

Systemtic Name: propyl 3,4-bis[[4-[5-(8-prop-2-enoyloxyoctoxy)pyrimidin-2-yl]phenyl]carbonyloxy]benzoate Openeye Name: propyl 3,4-bis[[4-[5-(8-prop-2-enoyloxyoctoxy)pyrimidin-2-yl]benzoyl]oxy]benzoate CAS Name: 3,4-bis[oxo-[4-[5-[8-(1-oxoprop-2-enoxy)octoxy]-2-pyrimidinyl]phenyl]methoxy]benzoic acid propyl ester IUPAC Name: propyl 3,4-bis[[4-[5-(8-prop-2-enoyloxyoctoxy)pyrimidin-2-yl]benzoyl]oxy]benzoate Traditional Name: 3,4-bis[[4-[5-(8-acryloyloxyoctoxy)pyrimidin-2-yl]benzoyl]oxy]benzoic acid propyl ester Formula: C54H60N4O12 MolecularWeight: 957.0738

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=NC=C(C=N3)OCCCCCCCCOC(=O)C=C)OC(=O)C4=CC=C(C=C4)C5=NC=C(C=N5)OCCCCCCCCOC(=O)C=C

Isomeric SMILES

CCCOC(=O)C1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=NC=C(C=N3)OCCCCCCCCOC(=O)C=C)OC(=O)C4=CC=C(C=C4)C5=NC=C(C=N5)OCCCCCCCCOC(=O)C=C

InChI

InChI=1S/C54H60N4O12/c1-4-29-68-52(61)43-27-28-46(69-53(62)41-23-19-39(20-24-41)50-55-35-44(36-56-50)64-30-15-11-7-9-13-17-32-66-48(59)5-2)47(34-43)70-54(63)42-25-21-40(22-26-42)51-57-37-45(38-58-51)65-31-16-12-8-10-14-18-33-67-49(60)6-3/h5-6,19-28,34-38H,2-4,7-18,29-33H2,1H3