1-chloroethyl 2,3-bis(oxidanyl)-4-oxidanylidene-2-(1-oxidanyl-2-oxidanylidene-heptadecyl)nonadecanoate

Systemtic Name: 1-chloroethyl 2,3-bis(oxidanyl)-4-oxidanylidene-2-(1-oxidanyl-2-oxidanylidene-heptadecyl)nonadecanoate Openeye Name: 1-chloroethyl 2,3-dihydroxy-2-(1-hydroxy-2-oxo-heptadecyl)-4-oxo-nonadecanoate CAS Name: 2,3-dihydroxy-2-(1-hydroxy-2-oxoheptadecyl)-4-oxononadecanoic acid 1-chloroethyl ester IUPAC Name: 1-chloroethyl 2,3-dihydroxy-2-(1-hydroxy-2-oxoheptadecyl)-4-oxononadecanoate Traditional Name: 2,3-dihydroxy-2-(1-hydroxy-2-keto-heptadecyl)-4-keto-nonadecanoic acid 1-chloroethyl ester Formula: C38H71ClO7 MolecularWeight: 675.41914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C(C(C(=O)CCCCCCCCCCCCCCC)O)(C(=O)OC(C)Cl)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C(C(C(=O)CCCCCCCCCCCCCCC)O)(C(=O)OC(C)Cl)O)O

InChI

InChI=1S/C38H71ClO7/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-33(40)35(42)38(45,37(44)46-32(3)39)36(43)34(41)31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h32,35-36,42-43,45H,4-31H2,1-3H3