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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-chloranyl-1,3-dimethyl-pyrazole-4-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-chloro-1,3-dimethyl-pyrazole-4-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-chloro-1,3-dimethyl-4-pyrazolecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-chloro-1,3-dimethylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-homopiperonyl-1,3-dimethyl-pyrazole-4-carboxamide Formula: C15H16ClN3O3 MolecularWeight: 321.75884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCC2=CC3=C(C=C2)OCO3)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCC2=CC3=C(C=C2)OCO3)Cl)C

InChI

InChI=1S/C15H16ClN3O3/c1-9-13(14(16)19(2)18-9)15(20)17-6-5-10-3-4-11-12(7-10)22-8-21-11/h3-4,7H,5-6,8H2,1-2H3,(H,17,20)