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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-chloranyl-1,3-dimethyl-pyrazole-4-sulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-chloro-1,3-dimethyl-pyrazole-4-sulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-chloro-1,3-dimethyl-4-pyrazolesulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-chloro-1,3-dimethylpyrazole-4-sulfonamide Traditional Name: 5-chloro-N-homopiperonyl-1,3-dimethyl-pyrazole-4-sulfonamide Formula: C14H16ClN3O4S MolecularWeight: 357.81254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)NCCC2=CC3=C(C=C2)OCO3)Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)NCCC2=CC3=C(C=C2)OCO3)Cl)C

InChI

InChI=1S/C14H16ClN3O4S/c1-9-13(14(15)18(2)17-9)23(19,20)16-6-5-10-3-4-11-12(7-10)22-8-21-11/h3-4,7,16H,5-6,8H2,1-2H3