(1,3-diphenylpyrazol-4-yl)methyl 4-tert-butylbenzoate

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl 4-tert-butylbenzoate Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid (1,3-diphenyl-4-pyrazolyl)methyl ester IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid (1,3-diphenylpyrazol-4-yl)methyl ester Formula: C27H26N2O2 MolecularWeight: 410.50754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N2O2/c1-27(2,3)23-16-14-21(15-17-23)26(30)31-19-22-18-29(24-12-8-5-9-13-24)28-25(22)20-10-6-4-7-11-20/h4-18H,19H2,1-3H3