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3,5-bis(11-methoxy-11-oxidanylidene-undecoxy)benzoic acid

3,5-bis(11-methoxy-11-oxidanylidene-undecoxy)benzoic acid

Systemtic Name:3,5-bis(11-methoxy-11-oxidanylidene-undecoxy)benzoic acid
Openeye Name:3,5-bis(11-methoxy-11-oxo-undecoxy)benzoic acid
CAS Name:3,5-bis(11-methoxy-11-oxoundecoxy)benzoic acid
IUPAC Name:3,5-bis(11-methoxy-11-oxoundecoxy)benzoic acid
Traditional Name:3,5-bis(11-keto-11-methoxy-undecoxy)benzoic acid
Formula: C31H50O8
MolecularWeight: 550.7239
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCCCCOC1=CC(=CC(=C1)C(=O)O)OCCCCCCCCCCC(=O)OC


Isomeric SMILES

COC(=O)CCCCCCCCCCOC1=CC(=CC(=C1)C(=O)O)OCCCCCCCCCCC(=O)OC


InChI

InChI=1S/C31H50O8/c1-36-29(32)19-15-11-7-3-5-9-13-17-21-38-27-23-26(31(34)35)24-28(25-27)39-22-18-14-10-6-4-8-12-16-20-30(33)37-2/h23-25H,3-22H2,1-2H3,(H,34,35)


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