(4-pyrazol-1-ylphenyl)methyl 3-acetamidobenzoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 3-acetamidobenzoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid (4-pyrazol-1-ylbenzyl) ester Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C19H17N3O3/c1-14(23)21-17-5-2-4-16(12-17)19(24)25-13-15-6-8-18(9-7-15)22-11-3-10-20-22/h2-12H,13H2,1H3,(H,21,23)