N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-ethanamide

Systemtic Name: N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-ethanamide Openeye Name: N-[2-(2-furylmethylamino)-2-oxo-ethyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-acetamide CAS Name: N-[2-(2-furanylmethylamino)-2-oxoethyl]-2-[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]-N-methylacetamide IUPAC Name: N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-methylacetamide Traditional Name: N-[2-(2-furfurylamino)-2-keto-ethyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-acetamide Formula: C21H29N4O4+ MolecularWeight: 401.47936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N4O4/c1-23(15-20(26)22-14-19-7-4-12-29-19)21(27)16-24-8-10-25(11-9-24)17-5-3-6-18(13-17)28-2/h3-7,12-13H,8-11,14-16H2,1-2H3,(H,22,26)/p+1