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13-oxidanyltridecyl (E)-11-oxidanylidene-2-pentyl-undec-3-enoate

Systemtic Name:	13-oxidanyltridecyl (E)-11-oxidanylidene-2-pentyl-undec-3-enoate
Openeye Name:	13-hydroxytridecyl (E)-11-oxo-2-pentyl-undec-3-enoate
CAS Name:	(E)-11-oxo-2-pentyl-3-undecenoic acid 13-hydroxytridecyl ester
IUPAC Name:	13-hydroxytridecyl (E)-11-oxo-2-pentylundec-3-enoate
Traditional Name:	(E)-2-amyl-11-keto-undec-3-enoic acid 13-hydroxytridecyl ester
Formula:	C₂₉H₅₄O₄
MolecularWeight:	466.73666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CCCCCCCC=O)C(=O)OCCCCCCCCCCCCCO

Isomeric SMILES

CCCCCC(/C=C/CCCCCCC=O)C(=O)OCCCCCCCCCCCCCO

InChI

InChI=1S/C29H54O4/c1-2-3-18-23-28(24-19-14-10-9-12-16-21-26-31)29(32)33-27-22-17-13-8-6-4-5-7-11-15-20-25-30/h19,24,26,28,30H,2-18,20-23,25,27H2,1H3/b24-19+

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