[4-(2-dimethylaminoethyloxy)-2-methyl-5-propan-2-yl-phenyl] 7,7-dimethyl-3-oxidanylidene-bicyclo[2.2.1]heptane-4-sulfonate

Systemtic Name: [4-(2-dimethylaminoethyloxy)-2-methyl-5-propan-2-yl-phenyl] 7,7-dimethyl-3-oxidanylidene-bicyclo[2.2.1]heptane-4-sulfonate Openeye Name: [4-(2-dimethylaminoethyloxy)-5-isopropyl-2-methyl-phenyl] 7,7-dimethyl-2-oxo-norbornane-1-sulfonate CAS Name: 7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanesulfonic acid [4-(2-dimethylaminoethyloxy)-2-methyl-5-propan-2-ylphenyl] ester IUPAC Name: [4-(2-dimethylaminoethyloxy)-2-methyl-5-propan-2-ylphenyl] 7,7-dimethyl-3-oxobicyclo[2.2.1]heptane-4-sulfonate Traditional Name: 2-keto-7,7-dimethyl-norbornane-1-sulfonic acid [4-(2-dimethylaminoethyloxy)-5-isopropyl-2-methyl-phenyl] ester Formula: C23H35NO5S MolecularWeight: 437.5927

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OS(=O)(=O)C23CCC(C2(C)C)CC3=O)C(C)C)OCCN(C)C

Isomeric SMILES

CC1=CC(=C(C=C1OS(=O)(=O)C23CCC(C2(C)C)CC3=O)C(C)C)OCCN(C)C

InChI

InChI=1S/C23H35NO5S/c1-15(2)18-14-19(16(3)12-20(18)28-11-10-24(6)7)29-30(26,27)23-9-8-17(13-21(23)25)22(23,4)5/h12,14-15,17H,8-11,13H2,1-7H3