5-hept-6-enyl-4-(3-octan-2-yloxy-4-phenyl-phenyl)-1,3-dioxane

Systemtic Name: 5-hept-6-enyl-4-(3-octan-2-yloxy-4-phenyl-phenyl)-1,3-dioxane Openeye Name: 5-hept-6-enyl-4-[3-(1-methylheptoxy)-4-phenyl-phenyl]-1,3-dioxane CAS Name: 5-hept-6-enyl-4-(3-octan-2-yloxy-4-phenylphenyl)-1,3-dioxane IUPAC Name: 5-hept-6-enyl-4-(3-octan-2-yloxy-4-phenylphenyl)-1,3-dioxane Traditional Name: 5-hept-6-enyl-4-[3-(1-methylheptoxy)-4-phenyl-phenyl]-1,3-dioxane Formula: C31H44O3 MolecularWeight: 464.67926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=C(C=CC(=C1)C2C(COCO2)CCCCCC=C)C3=CC=CC=C3

Isomeric SMILES

CCCCCCC(C)OC1=C(C=CC(=C1)C2C(COCO2)CCCCCC=C)C3=CC=CC=C3

InChI

InChI=1S/C31H44O3/c1-4-6-8-10-13-19-28-23-32-24-33-31(28)27-20-21-29(26-17-14-11-15-18-26)30(22-27)34-25(3)16-12-9-7-5-2/h4,11,14-15,17-18,20-22,25,28,31H,1,5-10,12-13,16,19,23-24H2,2-3H3