N-[2-(1,3-benzodioxol-5-yl)ethyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3,5-dimethyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3,5-dimethyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-homopiperonyl-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21N3O3/c1-14-20(15(2)24(23-14)17-6-4-3-5-7-17)21(25)22-11-10-16-8-9-18-19(12-16)27-13-26-18/h3-9,12H,10-11,13H2,1-2H3,(H,22,25)