(E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromanyl-4-methoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromanyl-4-methoxy-phenyl)prop-2-enamide Openeye Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromo-4-methoxy-phenyl)prop-2-enamide CAS Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromo-4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromo-4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(3-bromo-4-methoxy-phenyl)-N-piperonyl-acrylamide Formula: C18H16BrNO4 MolecularWeight: 390.22794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16BrNO4/c1-22-15-5-2-12(8-14(15)19)4-7-18(21)20-10-13-3-6-16-17(9-13)24-11-23-16/h2-9H,10-11H2,1H3,(H,20,21)/b7-4+