[4-[4-oxidanylidene-3,5,7-tri(undec-10-enoyloxy)chromen-2-yl]-2-undec-10-enoyloxy-phenyl] undec-10-enoate

Systemtic Name: [4-[4-oxidanylidene-3,5,7-tri(undec-10-enoyloxy)chromen-2-yl]-2-undec-10-enoyloxy-phenyl] undec-10-enoate Openeye Name: [4-[4-oxo-3,5,7-tri(undec-10-enoyloxy)chromen-2-yl]-2-undec-10-enoyloxy-phenyl] undec-10-enoate CAS Name: 10-undecenoic acid [4-[4-oxo-3,5,7-tris(1-oxoundec-10-enoxy)-1-benzopyran-2-yl]-2-(1-oxoundec-10-enoxy)phenyl] ester IUPAC Name: [4-[4-oxo-3,5,7-tri(undec-10-enoyloxy)chromen-2-yl]-2-undec-10-enoyloxyphenyl] undec-10-enoate Traditional Name: undec-10-enoic acid [4-[4-keto-3,5,7-tri(undec-10-enoyloxy)chromen-2-yl]-2-undec-10-enoyloxy-phenyl] ester Formula: C70H100O12 MolecularWeight: 1133.5358

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCCCC(=O)OC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC(=O)CCCCCCCCC=C)OC(=O)CCCCCCCCC=C)OC(=O)CCCCCCCCC=C)OC(=O)CCCCCCCCC=C

Isomeric SMILES

C=CCCCCCCCCC(=O)OC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC(=O)CCCCCCCCC=C)OC(=O)CCCCCCCCC=C)OC(=O)CCCCCCCCC=C)OC(=O)CCCCCCCCC=C

InChI

InChI=1S/C70H100O12/c1-6-11-16-21-26-31-36-41-46-62(71)77-57-54-60(80-65(74)49-44-39-34-29-24-19-14-9-4)67-61(55-57)81-69(70(68(67)76)82-66(75)50-45-40-35-30-25-20-15-10-5)56-51-52-58(78-63(72)47-42-37-32-27-22-17-12-7-2)59(53-56)79-64(73)48-43-38-33-28-23-18-13-8-3/h6-10,51-55H,1-5,11-50H2