N-(1,3-benzodioxol-5-ylmethyl)-3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]propanamide Traditional Name: 3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)-N-piperonyl-propionamide Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C)C)CCC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C(=NN1CC(C)C)C)CCC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H27N3O3/c1-13(2)11-23-15(4)17(14(3)22-23)6-8-20(24)21-10-16-5-7-18-19(9-16)26-12-25-18/h5,7,9,13H,6,8,10-12H2,1-4H3,(H,21,24)