tert-butyl 4-azanyl-3-(3,4-dimethoxyphenyl)-5-methyl-pyrazole-1-carboxylate

Systemtic Name: tert-butyl 4-azanyl-3-(3,4-dimethoxyphenyl)-5-methyl-pyrazole-1-carboxylate Openeye Name: tert-butyl 4-amino-3-(3,4-dimethoxyphenyl)-5-methyl-pyrazole-1-carboxylate CAS Name: 4-amino-3-(3,4-dimethoxyphenyl)-5-methyl-1-pyrazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-amino-3-(3,4-dimethoxyphenyl)-5-methylpyrazole-1-carboxylate Traditional Name: 4-amino-3-(3,4-dimethoxyphenyl)-5-methyl-pyrazole-1-carboxylic acid tert-butyl ester Formula: C17H23N3O4 MolecularWeight: 333.38222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)OC(C)(C)C)C2=CC(=C(C=C2)OC)OC)N

Isomeric SMILES

CC1=C(C(=NN1C(=O)OC(C)(C)C)C2=CC(=C(C=C2)OC)OC)N

InChI

InChI=1S/C17H23N3O4/c1-10-14(18)15(19-20(10)16(21)24-17(2,3)4)11-7-8-12(22-5)13(9-11)23-6/h7-9H,18H2,1-6H3