[1-[(4-methylphenyl)methyl]pyrazol-4-yl] hydrogen carbonate

Systemtic Name: [1-[(4-methylphenyl)methyl]pyrazol-4-yl] hydrogen carbonate Openeye Name: [1-(p-tolylmethyl)pyrazol-4-yl] hydrogen carbonate CAS Name: carbonic acid [1-[(4-methylphenyl)methyl]-4-pyrazolyl] ester IUPAC Name: [1-[(4-methylphenyl)methyl]pyrazol-4-yl] hydrogen carbonate Traditional Name: carbonic acid [1-(4-methylbenzyl)pyrazol-4-yl] ester Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C=N2)OC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C=N2)OC(=O)O

InChI

InChI=1S/C12H12N2O3/c1-9-2-4-10(5-3-9)7-14-8-11(6-13-14)17-12(15)16/h2-6,8H,7H2,1H3,(H,15,16)