[2-(2,5-dimethylphenyl)-8-methyl-3-oxidanylidene-4-azaspiro[4.5]dec-1-en-1-yl] methanesulfonate

Systemtic Name: [2-(2,5-dimethylphenyl)-8-methyl-3-oxidanylidene-4-azaspiro[4.5]dec-1-en-1-yl] methanesulfonate Openeye Name: [2-(2,5-dimethylphenyl)-8-methyl-3-oxo-4-azaspiro[4.5]dec-1-en-1-yl] methanesulfonate CAS Name: methanesulfonic acid [2-(2,5-dimethylphenyl)-8-methyl-3-oxo-4-azaspiro[4.5]dec-1-en-1-yl] ester IUPAC Name: [2-(2,5-dimethylphenyl)-8-methyl-3-oxo-4-azaspiro[4.5]dec-1-en-1-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-(2,5-dimethylphenyl)-3-keto-8-methyl-4-azaspiro[4.5]dec-1-en-1-yl] ester Formula: C19H25NO4S MolecularWeight: 363.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2(CC1)C(=C(C(=O)N2)C3=C(C=CC(=C3)C)C)OS(=O)(=O)C

Isomeric SMILES

CC1CCC2(CC1)C(=C(C(=O)N2)C3=C(C=CC(=C3)C)C)OS(=O)(=O)C

InChI

InChI=1S/C19H25NO4S/c1-12-7-9-19(10-8-12)17(24-25(4,22)23)16(18(21)20-19)15-11-13(2)5-6-14(15)3/h5-6,11-12H,7-10H2,1-4H3,(H,20,21)