N-(1,3-benzodioxol-5-ylmethyl)-2-bromanyl-3-methyl-butanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-bromanyl-3-methyl-butanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-bromo-3-methyl-butanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-bromo-3-methylbutanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-bromo-3-methylbutanamide Traditional Name: 2-bromo-3-methyl-N-piperonyl-butyramide Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC2=C(C=C1)OCO2)Br

Isomeric SMILES

CC(C)C(C(=O)NCC1=CC2=C(C=C1)OCO2)Br

InChI

InChI=1S/C13H16BrNO3/c1-8(2)12(14)13(16)15-6-9-3-4-10-11(5-9)18-7-17-10/h3-5,8,12H,6-7H2,1-2H3,(H,15,16)