(E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(1-butyl-5-chloro-3-methylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-3-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-N-piperonyl-acrylamide Formula: C19H22ClN3O3 MolecularWeight: 375.84928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=CC(=O)NCC2=CC3=C(C=C2)OCO3)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)NCC2=CC3=C(C=C2)OCO3)Cl

InChI

InChI=1S/C19H22ClN3O3/c1-3-4-9-23-19(20)15(13(2)22-23)6-8-18(24)21-11-14-5-7-16-17(10-14)26-12-25-16/h5-8,10H,3-4,9,11-12H2,1-2H3,(H,21,24)/b8-6+