methyl 3-chloranylsulfonyl-4-hexadecoxy-benzoate

Systemtic Name: methyl 3-chloranylsulfonyl-4-hexadecoxy-benzoate Openeye Name: methyl 3-chlorosulfonyl-4-hexadecoxy-benzoate CAS Name: 3-chlorosulfonyl-4-hexadecoxybenzoic acid methyl ester IUPAC Name: methyl 3-chlorosulfonyl-4-hexadecoxybenzoate Traditional Name: 4-cetyloxy-3-chlorosulfonyl-benzoic acid methyl ester Formula: C24H39ClO5S MolecularWeight: 475.08146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)OC)S(=O)(=O)Cl

InChI

InChI=1S/C24H39ClO5S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-30-22-18-17-21(24(26)29-2)20-23(22)31(25,27)28/h17-18,20H,3-16,19H2,1-2H3