N-(1,3-benzodioxol-5-ylmethyl)-2-bromanyl-3,4,5-trimethoxy-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-bromanyl-3,4,5-trimethoxy-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-bromo-3,4,5-trimethoxy-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-bromo-3,4,5-trimethoxybenzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-bromo-3,4,5-trimethoxybenzamide Traditional Name: 2-bromo-3,4,5-trimethoxy-N-piperonyl-benzamide Formula: C18H18BrNO6 MolecularWeight: 424.24262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NCC2=CC3=C(C=C2)OCO3)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NCC2=CC3=C(C=C2)OCO3)Br)OC)OC

InChI

InChI=1S/C18H18BrNO6/c1-22-14-7-11(15(19)17(24-3)16(14)23-2)18(21)20-8-10-4-5-12-13(6-10)26-9-25-12/h4-7H,8-9H2,1-3H3,(H,20,21)