[4-(4-dodecoxyphenyl)phenyl] 2-(4-heptylphenyl)-3,4-dihydro-2H-chromene-6-carboxylate

Systemtic Name: [4-(4-dodecoxyphenyl)phenyl] 2-(4-heptylphenyl)-3,4-dihydro-2H-chromene-6-carboxylate Openeye Name: [4-(4-dodecoxyphenyl)phenyl] 2-(4-heptylphenyl)chromane-6-carboxylate CAS Name: 2-(4-heptylphenyl)-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid [4-(4-dodecoxyphenyl)phenyl] ester IUPAC Name: [4-(4-dodecoxyphenyl)phenyl] 2-(4-heptylphenyl)-3,4-dihydro-2H-chromene-6-carboxylate Traditional Name: 2-(4-heptylphenyl)chroman-6-carboxylic acid [4-(4-lauryloxyphenyl)phenyl] ester Formula: C47H60O4 MolecularWeight: 688.9769

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC4=C(C=C3)OC(CC4)C5=CC=C(C=C5)CCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC4=C(C=C3)OC(CC4)C5=CC=C(C=C5)CCCCCCC

InChI

InChI=1S/C47H60O4/c1-3-5-7-9-10-11-12-13-15-17-35-49-43-29-23-38(24-30-43)39-25-31-44(32-26-39)50-47(48)42-28-34-46-41(36-42)27-33-45(51-46)40-21-19-37(20-22-40)18-16-14-8-6-4-2/h19-26,28-32,34,36,45H,3-18,27,33,35H2,1-2H3