[2-(2-chlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 4-butoxybenzoate

Systemtic Name: [2-(2-chlorophenyl)-5-propan-2-yl-pyrazol-3-yl] 4-butoxybenzoate Openeye Name: [2-(2-chlorophenyl)-5-isopropyl-pyrazol-3-yl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-(2-chlorophenyl)-5-propan-2-yl-3-pyrazolyl] ester IUPAC Name: [2-(2-chlorophenyl)-5-propan-2-ylpyrazol-3-yl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-(2-chlorophenyl)-5-isopropyl-pyrazol-3-yl] ester Formula: C23H25ClN2O3 MolecularWeight: 412.9092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC=CC=C3Cl)C(C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=NN2C3=CC=CC=C3Cl)C(C)C

InChI

InChI=1S/C23H25ClN2O3/c1-4-5-14-28-18-12-10-17(11-13-18)23(27)29-22-15-20(16(2)3)25-26(22)21-9-7-6-8-19(21)24/h6-13,15-16H,4-5,14H2,1-3H3