4-(3-octan-2-yloxy-4-phenyl-phenyl)-5-undec-10-enyl-1,3-dioxane

Systemtic Name: 4-(3-octan-2-yloxy-4-phenyl-phenyl)-5-undec-10-enyl-1,3-dioxane Openeye Name: 4-[3-(1-methylheptoxy)-4-phenyl-phenyl]-5-undec-10-enyl-1,3-dioxane CAS Name: 4-(3-octan-2-yloxy-4-phenylphenyl)-5-undec-10-enyl-1,3-dioxane IUPAC Name: 4-(3-octan-2-yloxy-4-phenylphenyl)-5-undec-10-enyl-1,3-dioxane Traditional Name: 4-[3-(1-methylheptoxy)-4-phenyl-phenyl]-5-undec-10-enyl-1,3-dioxane Formula: C35H52O3 MolecularWeight: 520.78558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H52O3/c1-4-6-8-10-11-12-13-14-17-23-32-27-36-28-37-35(32)31-24-25-33(30-21-18-15-19-22-30)34(26-31)38-29(3)20-16-9-7-5-2/h4,15,18-19,21-22,24-26,29,32,35H,1,5-14,16-17,20,23,27-28H2,2-3H3