2-(2-carboxylatoprop-2-enoxymethyl)-3-octadecyl-henicos-2-enoate

Systemtic Name: 2-(2-carboxylatoprop-2-enoxymethyl)-3-octadecyl-henicos-2-enoate Openeye Name: 2-(2-carboxylatoallyloxymethyl)-3-octadecyl-henicos-2-enoate CAS Name: 2-(2-carboxylatoprop-2-enoxymethyl)-3-octadecyl-2-heneicosenoate IUPAC Name: 2-(2-carboxylatoprop-2-enoxymethyl)-3-octadecylhenicos-2-enoate Traditional Name: 2-(2-carboxylatoallyloxymethyl)-3-stearyl-heneicos-2-enoate Formula: C44H80O5-2 MolecularWeight: 689.103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(=C(COCC(=C)C(=O)[O-])C(=O)[O-])CCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(=C(COCC(=C)C(=O)[O-])C(=O)[O-])CCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C44H82O5/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-41(42(44(47)48)39-49-38-40(3)43(45)46)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h3-39H2,1-2H3,(H,45,46)(H,47,48)/p-2