tert-butyl 3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2-[(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)carbonylamino]propanoate

Systemtic Name: tert-butyl 3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2-[(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)carbonylamino]propanoate Openeye Name: tert-butyl 3-(4-tert-butoxyphenyl)-2-[(3-oxo-2-phenyl-1H-pyrazole-5-carbonyl)amino]propanoate CAS Name: 3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2-[[oxo-(3-oxo-2-phenyl-1H-pyrazol-5-yl)methyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2-[(3-oxo-2-phenyl-1H-pyrazole-5-carbonyl)amino]propanoate Traditional Name: 3-(4-tert-butoxyphenyl)-2-[(5-keto-1-phenyl-3-pyrazoline-3-carbonyl)amino]propionic acid tert-butyl ester Formula: C27H33N3O5 MolecularWeight: 479.56802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=CC=C(C=C1)CC(C(=O)OC(C)(C)C)NC(=O)C2=CC(=O)N(N2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC1=CC=C(C=C1)CC(C(=O)OC(C)(C)C)NC(=O)C2=CC(=O)N(N2)C3=CC=CC=C3

InChI

InChI=1S/C27H33N3O5/c1-26(2,3)34-20-14-12-18(13-15-20)16-22(25(33)35-27(4,5)6)28-24(32)21-17-23(31)30(29-21)19-10-8-7-9-11-19/h7-15,17,22,29H,16H2,1-6H3,(H,28,32)