hexadecan-2-yl 3-(5-hexadecan-2-yloxycarbonyl-2-oxidanyl-phenyl)sulfonyl-4-oxidanyl-benzoate

Systemtic Name: hexadecan-2-yl 3-(5-hexadecan-2-yloxycarbonyl-2-oxidanyl-phenyl)sulfonyl-4-oxidanyl-benzoate Openeye Name: 1-methylpentadecyl 4-hydroxy-3-[2-hydroxy-5-(1-methylpentadecoxycarbonyl)phenyl]sulfonyl-benzoate CAS Name: 3-[5-[hexadecan-2-yloxy(oxo)methyl]-2-hydroxyphenyl]sulfonyl-4-hydroxybenzoic acid hexadecan-2-yl ester IUPAC Name: hexadecan-2-yl 3-(5-hexadecan-2-yloxycarbonyl-2-hydroxyphenyl)sulfonyl-4-hydroxybenzoate Traditional Name: 4-hydroxy-3-[2-hydroxy-5-(1-methylpentadecoxycarbonyl)phenyl]sulfonyl-benzoic acid 1-methylpentadecyl ester Formula: C46H74O8S MolecularWeight: 787.13996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C)OC(=O)C1=CC(=C(C=C1)O)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC(C)CCCCCCCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCCCCCC(C)OC(=O)C1=CC(=C(C=C1)O)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC(C)CCCCCCCCCCCCCC)O

InChI

InChI=1S/C46H74O8S/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-37(3)53-45(49)39-31-33-41(47)43(35-39)55(51,52)44-36-40(32-34-42(44)48)46(50)54-38(4)30-28-26-24-22-20-18-16-14-12-10-8-6-2/h31-38,47-48H,5-30H2,1-4H3