[1-chloranyl-2,3-bis(oxidanyl)propyl] (9E,12E)-octadeca-9,12-dienoate

Systemtic Name: [1-chloranyl-2,3-bis(oxidanyl)propyl] (9E,12E)-octadeca-9,12-dienoate Openeye Name: (1-chloro-2,3-dihydroxy-propyl) (9E,12E)-octadeca-9,12-dienoate CAS Name: (9E,12E)-octadeca-9,12-dienoic acid (1-chloro-2,3-dihydroxypropyl) ester IUPAC Name: (1-chloro-2,3-dihydroxypropyl) (9E,12E)-octadeca-9,12-dienoate Traditional Name: (9E,12E)-octadeca-9,12-dienoic acid (1-chloro-2,3-dihydroxy-propyl) ester Formula: C21H37ClO4 MolecularWeight: 388.96908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)OC(C(CO)O)Cl

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCC(=O)OC(C(CO)O)Cl

InChI

InChI=1S/C21H37ClO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(25)26-21(22)19(24)18-23/h6-7,9-10,19,21,23-24H,2-5,8,11-18H2,1H3/b7-6+,10-9+