N-[2-[[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]phenyl]methylamino]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]phenyl]methylamino]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]phenyl]methylamino]-2-oxo-ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[[2-[(4-ethyl-1-piperazin-4-iumyl)methyl]phenyl]methylamino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]phenyl]methylamino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]benzyl]amino]-2-keto-ethyl]-piperonylamide Formula: C24H31N4O4+ MolecularWeight: 439.52734

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=CC=CC=C2CNC(=O)CNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=CC=CC=C2CNC(=O)CNC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H30N4O4/c1-2-27-9-11-28(12-10-27)16-20-6-4-3-5-19(20)14-25-23(29)15-26-24(30)18-7-8-21-22(13-18)32-17-31-21/h3-8,13H,2,9-12,14-17H2,1H3,(H,25,29)(H,26,30)/p+1