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

Systemtic Name: [8-methyl-3-oxidanylidene-2-(2,4,5-trimethylphenyl)-4-azaspiro[4.5]dec-1-en-1-yl] methanesulfonate Openeye Name: [8-methyl-3-oxo-2-(2,4,5-trimethylphenyl)-4-azaspiro[4.5]dec-1-en-1-yl] methanesulfonate CAS Name: methanesulfonic acid [8-methyl-3-oxo-2-(2,4,5-trimethylphenyl)-4-azaspiro[4.5]dec-1-en-1-yl] ester IUPAC Name: [8-methyl-3-oxo-2-(2,4,5-trimethylphenyl)-4-azaspiro[4.5]dec-1-en-1-yl] methanesulfonate Traditional Name: methanesulfonic acid [3-keto-8-methyl-2-(2,4,5-trimethylphenyl)-4-azaspiro[4.5]dec-1-en-1-yl] ester Formula: C20H27NO4S MolecularWeight: 377.49768

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2(CC1)C(=C(C(=O)N2)C3=CC(=C(C=C3C)C)C)OS(=O)(=O)C

Isomeric SMILES

CC1CCC2(CC1)C(=C(C(=O)N2)C3=CC(=C(C=C3C)C)C)OS(=O)(=O)C

InChI

InChI=1S/C20H27NO4S/c1-12-6-8-20(9-7-12)18(25-26(5,23)24)17(19(22)21-20)16-11-14(3)13(2)10-15(16)4/h10-12H,6-9H2,1-5H3,(H,21,22)