N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methyl-ethanamide

Systemtic Name: N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methyl-ethanamide Openeye Name: N-[2-(2-furylmethylamino)-2-oxo-ethyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methyl-acetamide CAS Name: N-[2-(2-furanylmethylamino)-2-oxoethyl]-2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-N-methylacetamide IUPAC Name: N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methylacetamide Traditional Name: N-[2-(2-furfurylamino)-2-keto-ethyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-methyl-acetamide Formula: C20H27N4O4+ MolecularWeight: 387.45278

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCC1=CC=CO1)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

CN(CC(=O)NCC1=CC=CO1)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C20H26N4O4/c1-22(14-19(26)21-13-18-3-2-12-28-18)20(27)15-23-8-10-24(11-9-23)16-4-6-17(25)7-5-16/h2-7,12,25H,8-11,13-15H2,1H3,(H,21,26)/p+1