2-[1-(4-methylphenyl)pyrazol-4-yl]ethyl methanesulfonate

Systemtic Name: 2-[1-(4-methylphenyl)pyrazol-4-yl]ethyl methanesulfonate Openeye Name: 2-[1-(p-tolyl)pyrazol-4-yl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[1-(4-methylphenyl)-4-pyrazolyl]ethyl ester IUPAC Name: 2-[1-(4-methylphenyl)pyrazol-4-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[1-(p-tolyl)pyrazol-4-yl]ethyl ester Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C=N2)CCOS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C=N2)CCOS(=O)(=O)C

InChI

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