N-(1,3-benzodioxol-5-yl)-4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)butanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)butanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)butanamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-(4-iodo-3,5-dimethyl-1-pyrazolyl)butanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-(4-iodo-3,5-dimethylpyrazol-1-yl)butanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)butyramide Formula: C16H18IN3O3 MolecularWeight: 427.23689

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)NC2=CC3=C(C=C2)OCO3)C)I

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)NC2=CC3=C(C=C2)OCO3)C)I

InChI

InChI=1S/C16H18IN3O3/c1-10-16(17)11(2)20(19-10)7-3-4-15(21)18-12-5-6-13-14(8-12)23-9-22-13/h5-6,8H,3-4,7,9H2,1-2H3,(H,18,21)