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

Systemtic Name: propyl 3,4-bis[[4-[5-(12-prop-2-enoyloxydodecoxy)pyrimidin-2-yl]phenyl]methoxy]benzoate Openeye Name: propyl 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 propyl ester IUPAC Name: propyl 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 propyl ester Formula: C62H80N4O10 MolecularWeight: 1041.3194

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=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

CCCOC(=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/C62H80N4O10/c1-4-37-74-62(69)53-35-36-56(75-47-49-27-31-51(32-28-49)60-63-43-54(44-64-60)70-38-23-19-15-11-7-9-13-17-21-25-40-72-58(67)5-2)57(42-53)76-48-50-29-33-52(34-30-50)61-65-45-55(46-66-61)71-39-24-20-16-12-8-10-14-18-22-26-41-73-59(68)6-3/h5-6,27-36,42-46H,2-4,7-26,37-41,47-48H2,1H3