ethyl 1-(4-methoxyphenyl)-5-[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(4-methoxyphenyl)-5-[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 5-[4-[(tert-butoxycarbonylamino)methyl]phenyl]-1-(4-methoxyphenyl)pyrazole-3-carboxylate CAS Name: 1-(4-methoxyphenyl)-5-[4-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methoxyphenyl)-5-[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]pyrazole-3-carboxylate Traditional Name: 5-[4-[(tert-butoxycarbonylamino)methyl]phenyl]-1-(4-methoxyphenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C25H29N3O5 MolecularWeight: 451.51486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)CNC(=O)OC(C)(C)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)CNC(=O)OC(C)(C)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H29N3O5/c1-6-32-23(29)21-15-22(28(27-21)19-11-13-20(31-5)14-12-19)18-9-7-17(8-10-18)16-26-24(30)33-25(2,3)4/h7-15H,6,16H2,1-5H3,(H,26,30)