2-(2-methylimidazol-1-yl)ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-(2-methylimidazol-1-yl)ethyl 4-methylbenzenesulfonate Openeye Name: 2-(2-methylimidazol-1-yl)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(2-methyl-1-imidazolyl)ethyl ester IUPAC Name: 2-(2-methylimidazol-1-yl)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(2-methylimidazol-1-yl)ethyl ester Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCN2C=CN=C2C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCN2C=CN=C2C

InChI

InChI=1S/C13H16N2O3S/c1-11-3-5-13(6-4-11)19(16,17)18-10-9-15-8-7-14-12(15)2/h3-8H,9-10H2,1-2H3