N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide

Systemtic Name: N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide Openeye Name: N-[(Z)-1,3-benzodioxol-5-ylmethyleneamino]-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide CAS Name: N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-3-(4-methyl-1-piperazine-1,4-diiumyl)propanamide IUPAC Name: N-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: 3-(4-methylpiperazine-1,4-diium-1-yl)-N-[(Z)-piperonylideneamino]propionamide Formula: C16H24N4O3+2 MolecularWeight: 320.38676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCC(=O)N/N=C\C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H22N4O3/c1-19-6-8-20(9-7-19)5-4-16(21)18-17-11-13-2-3-14-15(10-13)23-12-22-14/h2-3,10-11H,4-9,12H2,1H3,(H,18,21)/p+2/b17-11-