(phenylmethyl) N-[3-(2,4-dimethylphenyl)-5-ethyl-1H-pyrazol-4-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-(2,4-dimethylphenyl)-5-ethyl-1H-pyrazol-4-yl]carbamate Openeye Name: benzyl N-[3-(2,4-dimethylphenyl)-5-ethyl-1H-pyrazol-4-yl]carbamate CAS Name: N-[3-(2,4-dimethylphenyl)-5-ethyl-1H-pyrazol-4-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-(2,4-dimethylphenyl)-5-ethyl-1H-pyrazol-4-yl]carbamate Traditional Name: N-[3-(2,4-dimethylphenyl)-5-ethyl-1H-pyrazol-4-yl]carbamic acid benzyl ester Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1)C2=C(C=C(C=C2)C)C)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=NN1)C2=C(C=C(C=C2)C)C)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O2/c1-4-18-20(22-21(25)26-13-16-8-6-5-7-9-16)19(24-23-18)17-11-10-14(2)12-15(17)3/h5-12H,4,13H2,1-3H3,(H,22,25)(H,23,24)