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

Systemtic Name: [4-(4-dodecoxyphenyl)phenyl] 2-heptyl-3,4-dihydro-2H-chromene-6-carboxylate Openeye Name: [4-(4-dodecoxyphenyl)phenyl] 2-heptylchromane-6-carboxylate CAS Name: 2-heptyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid [4-(4-dodecoxyphenyl)phenyl] ester IUPAC Name: [4-(4-dodecoxyphenyl)phenyl] 2-heptyl-3,4-dihydro-2H-chromene-6-carboxylate Traditional Name: 2-heptylchroman-6-carboxylic acid [4-(4-lauryloxyphenyl)phenyl] ester Formula: C41H56O4 MolecularWeight: 612.88094

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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)CCCCCCC

Isomeric SMILES

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

InChI

InChI=1S/C41H56O4/c1-3-5-7-9-10-11-12-13-15-17-31-43-37-25-19-33(20-26-37)34-21-27-39(28-22-34)45-41(42)36-24-30-40-35(32-36)23-29-38(44-40)18-16-14-8-6-4-2/h19-22,24-28,30,32,38H,3-18,23,29,31H2,1-2H3