(3,5,5-trimethyl-4H-pyrazol-3-yl) 4-methoxybenzoate

Systemtic Name: (3,5,5-trimethyl-4H-pyrazol-3-yl) 4-methoxybenzoate Openeye Name: (3,5,5-trimethyl-4H-pyrazol-3-yl) 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid (3,5,5-trimethyl-4H-pyrazol-3-yl) ester IUPAC Name: (3,5,5-trimethyl-4H-pyrazol-3-yl) 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid (3,5,5-trimethyl-1-pyrazolin-3-yl) ester Formula: C14H18N2O3 MolecularWeight: 262.30432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(N=N1)(C)OC(=O)C2=CC=C(C=C2)OC)C

Isomeric SMILES

CC1(CC(N=N1)(C)OC(=O)C2=CC=C(C=C2)OC)C

InChI

InChI=1S/C14H18N2O3/c1-13(2)9-14(3,16-15-13)19-12(17)10-5-7-11(18-4)8-6-10/h5-8H,9H2,1-4H3