1-tert-butyl-N-[2-(3,4-diethoxyphenyl)ethyl]-5-methyl-pyrazole-4-carboxamide

Systemtic Name: 1-tert-butyl-N-[2-(3,4-diethoxyphenyl)ethyl]-5-methyl-pyrazole-4-carboxamide Openeye Name: 1-tert-butyl-N-[2-(3,4-diethoxyphenyl)ethyl]-5-methyl-pyrazole-4-carboxamide CAS Name: 1-tert-butyl-N-[2-(3,4-diethoxyphenyl)ethyl]-5-methyl-4-pyrazolecarboxamide IUPAC Name: 1-tert-butyl-N-[2-(3,4-diethoxyphenyl)ethyl]-5-methylpyrazole-4-carboxamide Traditional Name: 1-tert-butyl-N-[2-(3,4-diethoxyphenyl)ethyl]-5-methyl-pyrazole-4-carboxamide Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2=C(N(N=C2)C(C)(C)C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2=C(N(N=C2)C(C)(C)C)C)OCC

InChI

InChI=1S/C21H31N3O3/c1-7-26-18-10-9-16(13-19(18)27-8-2)11-12-22-20(25)17-14-23-24(15(17)3)21(4,5)6/h9-10,13-14H,7-8,11-12H2,1-6H3,(H,22,25)