tert-butyl 4-azanyl-5-ethyl-3-[2-(4-methoxyphenyl)ethyl]pyrazole-1-carboxylate

Systemtic Name: tert-butyl 4-azanyl-5-ethyl-3-[2-(4-methoxyphenyl)ethyl]pyrazole-1-carboxylate Openeye Name: tert-butyl 4-amino-5-ethyl-3-[2-(4-methoxyphenyl)ethyl]pyrazole-1-carboxylate CAS Name: 4-amino-5-ethyl-3-[2-(4-methoxyphenyl)ethyl]-1-pyrazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-amino-5-ethyl-3-[2-(4-methoxyphenyl)ethyl]pyrazole-1-carboxylate Traditional Name: 4-amino-5-ethyl-3-[2-(4-methoxyphenyl)ethyl]pyrazole-1-carboxylic acid tert-butyl ester Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C(=O)OC(C)(C)C)CCC2=CC=C(C=C2)OC)N

Isomeric SMILES

CCC1=C(C(=NN1C(=O)OC(C)(C)C)CCC2=CC=C(C=C2)OC)N

InChI

InChI=1S/C19H27N3O3/c1-6-16-17(20)15(21-22(16)18(23)25-19(2,3)4)12-9-13-7-10-14(24-5)11-8-13/h7-8,10-11H,6,9,12,20H2,1-5H3