2-[(4-methoxyphenyl)methyl]-4,7,7-trimethyl-3-oxidanylidene-bicyclo[2.2.1]heptane-2-sulfonate

Systemtic Name: 2-[(4-methoxyphenyl)methyl]-4,7,7-trimethyl-3-oxidanylidene-bicyclo[2.2.1]heptane-2-sulfonate Openeye Name: 2-[(4-methoxyphenyl)methyl]-4,7,7-trimethyl-3-oxo-norbornane-2-sulfonate CAS Name: 2-[(4-methoxyphenyl)methyl]-4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanesulfonate IUPAC Name: 2-[(4-methoxyphenyl)methyl]-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-sulfonate Traditional Name: 3-keto-4,7,7-trimethyl-2-p-anisyl-norbornane-2-sulfonate Formula: C18H23O5S- MolecularWeight: 351.43722

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(=O)C2(CC3=CC=C(C=C3)OC)S(=O)(=O)[O-])C)C

Isomeric SMILES

CC1(C2CCC1(C(=O)C2(CC3=CC=C(C=C3)OC)S(=O)(=O)[O-])C)C

InChI

InChI=1S/C18H24O5S/c1-16(2)14-9-10-17(16,3)15(19)18(14,24(20,21)22)11-12-5-7-13(23-4)8-6-12/h5-8,14H,9-11H2,1-4H3,(H,20,21,22)/p-1