2-methylpropyl 4-[[4-(3-methyl-5-phenyl-pyrazol-1-yl)phenyl]carbonylamino]benzoate

Systemtic Name: 2-methylpropyl 4-[[4-(3-methyl-5-phenyl-pyrazol-1-yl)phenyl]carbonylamino]benzoate Openeye Name: isobutyl 4-[[4-(3-methyl-5-phenyl-pyrazol-1-yl)benzoyl]amino]benzoate CAS Name: 4-[[[4-(3-methyl-5-phenyl-1-pyrazolyl)phenyl]-oxomethyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[[4-(3-methyl-5-phenylpyrazol-1-yl)benzoyl]amino]benzoate Traditional Name: 4-[[4-(3-methyl-5-phenyl-pyrazol-1-yl)benzoyl]amino]benzoic acid isobutyl ester Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)OCC(C)C

Isomeric SMILES

CC1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)OCC(C)C

InChI

InChI=1S/C28H27N3O3/c1-19(2)18-34-28(33)23-9-13-24(14-10-23)29-27(32)22-11-15-25(16-12-22)31-26(17-20(3)30-31)21-7-5-4-6-8-21/h4-17,19H,18H2,1-3H3,(H,29,32)