(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-N-(4-methylpiperazin-4-ium-1-yl)prop-2-enamide

Systemtic Name: (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-N-(4-methylpiperazin-4-ium-1-yl)prop-2-enamide Openeye Name: (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-N-(4-methylpiperazin-4-ium-1-yl)prop-2-enamide CAS Name: (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-N-(4-methyl-1-piperazin-4-iumyl)-2-propenamide IUPAC Name: (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-N-(4-methylpiperazin-4-ium-1-yl)prop-2-enamide Traditional Name: (E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-N-(4-methylpiperazin-4-ium-1-yl)acrylamide Formula: C17H24N3O4+ MolecularWeight: 334.39016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C=CC2=CC3=C(C(=C2)OC)OCCO3

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)/C=C/C2=CC3=C(C(=C2)OC)OCCO3

InChI

InChI=1S/C17H23N3O4/c1-19-5-7-20(8-6-19)18-16(21)4-3-13-11-14(22-2)17-15(12-13)23-9-10-24-17/h3-4,11-12H,5-10H2,1-2H3,(H,18,21)/p+1/b4-3+