methyl 3-(5-fluorosulfonyl-2-hexadecoxy-phenyl)-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-(5-fluorosulfonyl-2-hexadecoxy-phenyl)-3-oxidanylidene-propanoate Openeye Name: methyl 3-(5-fluorosulfonyl-2-hexadecoxy-phenyl)-3-oxo-propanoate CAS Name: 3-(5-fluorosulfonyl-2-hexadecoxyphenyl)-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-(5-fluorosulfonyl-2-hexadecoxyphenyl)-3-oxopropanoate Traditional Name: 3-(2-cetyloxy-5-fluorosulfonyl-phenyl)-3-keto-propionic acid methyl ester Formula: C26H41FO6S MolecularWeight: 500.663543

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)S(=O)(=O)F)C(=O)CC(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)S(=O)(=O)F)C(=O)CC(=O)OC

InChI

InChI=1S/C26H41FO6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-33-25-18-17-22(34(27,30)31)20-23(25)24(28)21-26(29)32-2/h17-18,20H,3-16,19,21H2,1-2H3