6-oxidanylidenehexyl 2-[(2-heptadecyl-1,3-dioxolan-4-yl)methoxy]-4-methyl-benzenesulfonate

Systemtic Name: 6-oxidanylidenehexyl 2-[(2-heptadecyl-1,3-dioxolan-4-yl)methoxy]-4-methyl-benzenesulfonate Openeye Name: 6-oxohexyl 2-[(2-heptadecyl-1,3-dioxolan-4-yl)methoxy]-4-methyl-benzenesulfonate CAS Name: 2-[(2-heptadecyl-1,3-dioxolan-4-yl)methoxy]-4-methylbenzenesulfonic acid 6-oxohexyl ester IUPAC Name: 6-oxohexyl 2-[(2-heptadecyl-1,3-dioxolan-4-yl)methoxy]-4-methylbenzenesulfonate Traditional Name: 2-[(2-heptadecyl-1,3-dioxolan-4-yl)methoxy]-4-methyl-benzenesulfonic acid 6-ketohexyl ester Formula: C34H58O7S MolecularWeight: 610.88512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1OCC(O1)COC2=C(C=CC(=C2)C)S(=O)(=O)OCCCCCC=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1OCC(O1)COC2=C(C=CC(=C2)C)S(=O)(=O)OCCCCCC=O

InChI

InChI=1S/C34H58O7S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-34-39-29-31(41-34)28-38-32-27-30(2)23-24-33(32)42(36,37)40-26-21-18-17-20-25-35/h23-25,27,31,34H,3-22,26,28-29H2,1-2H3