[4-[[4-(2-cyanophenyl)phenyl]methyl]-2-methyl-5-propyl-pyrazol-3-yl]methyl ethanoate

Systemtic Name: [4-[[4-(2-cyanophenyl)phenyl]methyl]-2-methyl-5-propyl-pyrazol-3-yl]methyl ethanoate Openeye Name: [4-[[4-(2-cyanophenyl)phenyl]methyl]-2-methyl-5-propyl-pyrazol-3-yl]methyl acetate CAS Name: acetic acid [4-[[4-(2-cyanophenyl)phenyl]methyl]-2-methyl-5-propyl-3-pyrazolyl]methyl ester IUPAC Name: [4-[[4-(2-cyanophenyl)phenyl]methyl]-2-methyl-5-propylpyrazol-3-yl]methyl acetate Traditional Name: acetic acid [4-[4-(2-cyanophenyl)benzyl]-2-methyl-5-propyl-pyrazol-3-yl]methyl ester Formula: C24H25N3O2 MolecularWeight: 387.4742

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)COC(=O)C)C

Isomeric SMILES

CCCC1=NN(C(=C1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)COC(=O)C)C

InChI

InChI=1S/C24H25N3O2/c1-4-7-23-22(24(27(3)26-23)16-29-17(2)28)14-18-10-12-19(13-11-18)21-9-6-5-8-20(21)15-25/h5-6,8-13H,4,7,14,16H2,1-3H3