methyl 2-(6-dodecoxypyridin-3-yl)sulfonylbutanoate

Systemtic Name: methyl 2-(6-dodecoxypyridin-3-yl)sulfonylbutanoate Openeye Name: methyl 2-[(6-dodecoxy-3-pyridyl)sulfonyl]butanoate CAS Name: 2-[(6-dodecoxy-3-pyridinyl)sulfonyl]butanoic acid methyl ester IUPAC Name: methyl 2-(6-dodecoxypyridin-3-yl)sulfonylbutanoate Traditional Name: 2-[(6-lauryloxy-3-pyridyl)sulfonyl]butyric acid methyl ester Formula: C22H37NO5S MolecularWeight: 427.59788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=NC=C(C=C1)S(=O)(=O)C(CC)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCOC1=NC=C(C=C1)S(=O)(=O)C(CC)C(=O)OC

InChI

InChI=1S/C22H37NO5S/c1-4-6-7-8-9-10-11-12-13-14-17-28-21-16-15-19(18-23-21)29(25,26)20(5-2)22(24)27-3/h15-16,18,20H,4-14,17H2,1-3H3