(4-pyrazol-1-ylphenyl)methyl 3-methoxy-4-methyl-benzoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 3-methoxy-4-methyl-benzoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 3-methoxy-4-methyl-benzoate CAS Name: 3-methoxy-4-methylbenzoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 3-methoxy-4-methylbenzoate Traditional Name: 3-methoxy-4-methyl-benzoic acid (4-pyrazol-1-ylbenzyl) ester Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O3/c1-14-4-7-16(12-18(14)23-2)19(22)24-13-15-5-8-17(9-6-15)21-11-3-10-20-21/h3-12H,13H2,1-2H3