(2-phenyl-5-propan-2-yl-pyrazol-3-yl) 4-butoxybenzoate

Systemtic Name: (2-phenyl-5-propan-2-yl-pyrazol-3-yl) 4-butoxybenzoate Openeye Name: (5-isopropyl-2-phenyl-pyrazol-3-yl) 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid (2-phenyl-5-propan-2-yl-3-pyrazolyl) ester IUPAC Name: (2-phenyl-5-propan-2-ylpyrazol-3-yl) 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid (5-isopropyl-2-phenyl-pyrazol-3-yl) ester Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC=CC=C3)C(C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C23H26N2O3/c1-4-5-15-27-20-13-11-18(12-14-20)23(26)28-22-16-21(17(2)3)24-25(22)19-9-7-6-8-10-19/h6-14,16-17H,4-5,15H2,1-3H3