(4-pyrazol-1-ylphenyl)methyl 2,4-dimethylbenzoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 2,4-dimethylbenzoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 2,4-dimethylbenzoate CAS Name: 2,4-dimethylbenzoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 2,4-dimethylbenzoate Traditional Name: 2,4-dimethylbenzoic acid (4-pyrazol-1-ylbenzyl) ester Formula: C19H18N2O2 MolecularWeight: 306.35842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3)C

InChI

InChI=1S/C19H18N2O2/c1-14-4-9-18(15(2)12-14)19(22)23-13-16-5-7-17(8-6-16)21-11-3-10-20-21/h3-12H,13H2,1-2H3