N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-5-(phenoxymethyl)furan-2-carboxamide

Systemtic Name: N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-5-(phenoxymethyl)furan-2-carboxamide Openeye Name: N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]-5-(phenoxymethyl)furan-2-carboxamide CAS Name: N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]-5-(phenoxymethyl)-2-furancarboxamide IUPAC Name: N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-5-(phenoxymethyl)furan-2-carboxamide Traditional Name: N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]-5-(phenoxymethyl)-2-furamide Formula: C22H25N4O3+ MolecularWeight: 393.4589

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC=C(O3)COC4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC=C(O3)COC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3/c1-25-11-13-26(14-12-25)21-10-7-17(15-23-21)24-22(27)20-9-8-19(29-20)16-28-18-5-3-2-4-6-18/h2-10,15H,11-14,16H2,1H3,(H,24,27)/p+1