ethyl 5-methyl-2-[3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 5-methyl-2-[3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]-1H-pyrazole-5-carboxylate Openeye Name: ethyl 2-[3-[(tert-butoxycarbonylamino)methyl]phenyl]-5-methyl-1H-pyrazole-5-carboxylate CAS Name: 5-methyl-2-[3-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]phenyl]-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-[3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]-1H-pyrazole-5-carboxylate Traditional Name: 1-[3-[(tert-butoxycarbonylamino)methyl]phenyl]-3-methyl-3-pyrazoline-3-carboxylic acid ethyl ester Formula: C19H27N3O4 MolecularWeight: 361.43538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C=CN(N1)C2=CC=CC(=C2)CNC(=O)OC(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1(C=CN(N1)C2=CC=CC(=C2)CNC(=O)OC(C)(C)C)C

InChI

InChI=1S/C19H27N3O4/c1-6-25-16(23)19(5)10-11-22(21-19)15-9-7-8-14(12-15)13-20-17(24)26-18(2,3)4/h7-12,21H,6,13H2,1-5H3,(H,20,24)