(4-pyrazol-1-ylphenyl)methyl 2-methylbenzoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 2-methylbenzoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 2-methylbenzoate CAS Name: 2-methylbenzoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 2-methylbenzoate Traditional Name: 2-methylbenzoic acid (4-pyrazol-1-ylbenzyl) ester Formula: C18H16N2O2 MolecularWeight: 292.33184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CC1=CC=CC=C1C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C18H16N2O2/c1-14-5-2-3-6-17(14)18(21)22-13-15-7-9-16(10-8-15)20-12-4-11-19-20/h2-12H,13H2,1H3