octadec-1-en-9-yl (E)-docos-13-enoate

Systemtic Name: octadec-1-en-9-yl (E)-docos-13-enoate Openeye Name: 1-oct-7-enyldecyl (E)-docos-13-enoate CAS Name: (E)-13-docosenoic acid octadec-1-en-9-yl ester IUPAC Name: octadec-1-en-9-yl (E)-docos-13-enoate Traditional Name: (E)-docos-13-enoic acid 1-nonylnon-8-enyl ester Formula: C40H76O2 MolecularWeight: 589.03024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCCC=C)OC(=O)CCCCCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCC(CCCCCCC=C)OC(=O)CCCCCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C40H76O2/c1-4-7-10-13-16-17-18-19-20-21-22-23-24-25-26-27-29-32-35-38-40(41)42-39(36-33-30-15-12-9-6-3)37-34-31-28-14-11-8-5-2/h6,19-20,39H,3-5,7-18,21-38H2,1-2H3/b20-19+