1-(1,3-benzoxazol-2-yl)-5-(2-methoxy-5-methyl-phenyl)pyrazole-3-carboxylate

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-5-(2-methoxy-5-methyl-phenyl)pyrazole-3-carboxylate Openeye Name: 1-(1,3-benzoxazol-2-yl)-5-(2-methoxy-5-methyl-phenyl)pyrazole-3-carboxylate CAS Name: 1-(1,3-benzoxazol-2-yl)-5-(2-methoxy-5-methylphenyl)-3-pyrazolecarboxylate IUPAC Name: 1-(1,3-benzoxazol-2-yl)-5-(2-methoxy-5-methylphenyl)pyrazole-3-carboxylate Traditional Name: 1-(1,3-benzoxazol-2-yl)-5-(2-methoxy-5-methyl-phenyl)pyrazole-3-carboxylate Formula: C19H14N3O4- MolecularWeight: 348.33216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C2=CC(=NN2C3=NC4=CC=CC=C4O3)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C2=CC(=NN2C3=NC4=CC=CC=C4O3)C(=O)[O-]

InChI

InChI=1S/C19H15N3O4/c1-11-7-8-16(25-2)12(9-11)15-10-14(18(23)24)21-22(15)19-20-13-5-3-4-6-17(13)26-19/h3-10H,1-2H3,(H,23,24)/p-1