(4-pyrazol-1-ylphenyl)methyl 5-methoxy-2-oxidanyl-benzoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 5-methoxy-2-oxidanyl-benzoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 2-hydroxy-5-methoxy-benzoate CAS Name: 2-hydroxy-5-methoxybenzoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 2-hydroxy-5-methoxybenzoate Traditional Name: 2-hydroxy-5-methoxy-benzoic acid (4-pyrazol-1-ylbenzyl) ester Formula: C18H16N2O4 MolecularWeight: 324.33064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

COC1=CC(=C(C=C1)O)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C18H16N2O4/c1-23-15-7-8-17(21)16(11-15)18(22)24-12-13-3-5-14(6-4-13)20-10-2-9-19-20/h2-11,21H,12H2,1H3