3-methyl-4-(3-methylhenicosan-4-yloxy)henicosane

Systemtic Name: 3-methyl-4-(3-methylhenicosan-4-yloxy)henicosane Openeye Name: 3-methyl-4-(1-sec-butyloctadecoxy)henicosane CAS Name: 3-methyl-4-(3-methylheneicosan-4-yloxy)heneicosane IUPAC Name: 3-methyl-4-(3-methylhenicosan-4-yloxy)henicosane Traditional Name: 3-methyl-4-(1-sec-butyloctadecoxy)heneicosane Formula: C44H90O MolecularWeight: 635.1848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(C(C)CC)OC(CCCCCCCCCCCCCCCCC)C(C)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(C(C)CC)OC(CCCCCCCCCCCCCCCCC)C(C)CC

InChI

InChI=1S/C44H90O/c1-7-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-43(41(5)9-3)45-44(42(6)10-4)40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-8-2/h41-44H,7-40H2,1-6H3