[2-(2-chloranyl-4-methyl-phenyl)-8-methoxy-3-oxidanylidene-4-oxaspiro[4.5]dec-1-en-1-yl] methanesulfonate

Systemtic Name: [2-(2-chloranyl-4-methyl-phenyl)-8-methoxy-3-oxidanylidene-4-oxaspiro[4.5]dec-1-en-1-yl] methanesulfonate Openeye Name: [2-(2-chloro-4-methyl-phenyl)-8-methoxy-3-oxo-4-oxaspiro[4.5]dec-1-en-1-yl] methanesulfonate CAS Name: methanesulfonic acid [2-(2-chloro-4-methylphenyl)-8-methoxy-3-oxo-4-oxaspiro[4.5]dec-1-en-1-yl] ester IUPAC Name: [2-(2-chloro-4-methylphenyl)-8-methoxy-3-oxo-4-oxaspiro[4.5]dec-1-en-1-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-(2-chloro-4-methyl-phenyl)-3-keto-8-methoxy-4-oxaspiro[4.5]dec-1-en-1-yl] ester Formula: C18H21ClO6S MolecularWeight: 400.87374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(C3(CCC(CC3)OC)OC2=O)OS(=O)(=O)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(C3(CCC(CC3)OC)OC2=O)OS(=O)(=O)C)Cl

InChI

InChI=1S/C18H21ClO6S/c1-11-4-5-13(14(19)10-11)15-16(25-26(3,21)22)18(24-17(15)20)8-6-12(23-2)7-9-18/h4-5,10,12H,6-9H2,1-3H3