N-(1,3-benzodioxol-5-yl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-(2-pyridin-1-iumyl)-1-piperazinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-pyridin-1-ium-2-ylpiperazine-1-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide Formula: C17H19N4O3+ MolecularWeight: 327.35776

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H18N4O3/c22-17(19-13-4-5-14-15(11-13)24-12-23-14)21-9-7-20(8-10-21)16-3-1-2-6-18-16/h1-6,11H,7-10,12H2,(H,19,22)/p+1