2-ethyl-2-methyl-1,3-dihydroisoindol-2-ium; 4-methylbenzenesulfonic acid

Systemtic Name: 2-ethyl-2-methyl-1,3-dihydroisoindol-2-ium; 4-methylbenzenesulfonic acid Openeye Name: 2-ethyl-2-methyl-isoindolin-2-ium; 4-methylbenzenesulfonic acid CAS Name: 2-ethyl-2-methyl-1,3-dihydroisoindol-2-ium; 4-methylbenzenesulfonic acid IUPAC Name: 2-ethyl-2-methyl-1,3-dihydroisoindol-2-ium; 4-methylbenzenesulfonic acid Traditional Name: 2-ethyl-2-methyl-isoindolin-2-ium; tosylic acid Formula: C18H24NO3S+ MolecularWeight: 334.45306

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CC2=CC=CC=C2C1)C.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CC[N+]1(CC2=CC=CC=C2C1)C.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C11H16N.C7H8O3S/c1-3-12(2)8-10-6-4-5-7-11(10)9-12;1-6-2-4-7(5-3-6)11(8,9)10/h4-7H,3,8-9H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;