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

Systemtic Name: ethyl 5-[[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]methyl]-3-propan-2-yl-1-propyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[4-[2-(tert-butoxycarbonylamino)phenyl]phenyl]methyl]-3-isopropyl-1-propyl-pyrazole-4-carboxylate CAS Name: 5-[[4-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]phenyl]methyl]-3-propan-2-yl-1-propyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]methyl]-3-propan-2-yl-1-propylpyrazole-4-carboxylate Traditional Name: 5-[4-[2-(tert-butoxycarbonylamino)phenyl]benzyl]-3-isopropyl-1-propyl-pyrazole-4-carboxylic acid ethyl ester Formula: C30H39N3O4 MolecularWeight: 505.64836

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=N1)C(C)C)C(=O)OCC)CC2=CC=C(C=C2)C3=CC=CC=C3NC(=O)OC(C)(C)C

Isomeric SMILES

CCCN1C(=C(C(=N1)C(C)C)C(=O)OCC)CC2=CC=C(C=C2)C3=CC=CC=C3NC(=O)OC(C)(C)C

InChI

InChI=1S/C30H39N3O4/c1-8-18-33-25(26(28(34)36-9-2)27(32-33)20(3)4)19-21-14-16-22(17-15-21)23-12-10-11-13-24(23)31-29(35)37-30(5,6)7/h10-17,20H,8-9,18-19H2,1-7H3,(H,31,35)