N-[(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-methylpiperazine-1,4-diium-1-yl)ethanamide

Systemtic Name: N-[(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-methylpiperazine-1,4-diium-1-yl)ethanamide Openeye Name: N-[(7-methoxy-1,3-benzodioxol-5-yl)methyleneamino]-2-(4-methylpiperazine-1,4-diium-1-yl)acetamide CAS Name: N-[(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-methyl-1-piperazine-1,4-diiumyl)acetamide IUPAC Name: N-[(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]-2-(4-methylpiperazine-1,4-diium-1-yl)acetamide Traditional Name: N-[(7-methoxy-1,3-benzodioxol-5-yl)methyleneamino]-2-(4-methylpiperazine-1,4-diium-1-yl)acetamide Formula: C16H24N4O4+2 MolecularWeight: 336.38616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC(=O)NN=CC2=CC3=C(C(=C2)OC)OCO3

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC(=O)NN=CC2=CC3=C(C(=C2)OC)OCO3

InChI

InChI=1S/C16H22N4O4/c1-19-3-5-20(6-4-19)10-15(21)18-17-9-12-7-13(22-2)16-14(8-12)23-11-24-16/h7-9H,3-6,10-11H2,1-2H3,(H,18,21)/p+2