2-[[5-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]furan-2-yl]carbonylamino]ethanoate

Systemtic Name: 2-[[5-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]furan-2-yl]carbonylamino]ethanoate Openeye Name: 2-[[5-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]furan-2-carbonyl]amino]acetate CAS Name: 2-[[[5-methyl-4-[(4-methyl-1-piperazin-4-iumyl)methyl]-2-furanyl]-oxomethyl]amino]acetate IUPAC Name: 2-[[5-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]furan-2-carbonyl]amino]acetate Traditional Name: 2-[[5-methyl-4-[(4-methylpiperazin-4-ium-1-yl)methyl]-2-furoyl]amino]acetate Formula: C14H21N3O4 MolecularWeight: 295.33424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)NCC(=O)[O-])CN2CC[NH+](CC2)C

Isomeric SMILES

CC1=C(C=C(O1)C(=O)NCC(=O)[O-])CN2CC[NH+](CC2)C

InChI

InChI=1S/C14H21N3O4/c1-10-11(9-17-5-3-16(2)4-6-17)7-12(21-10)14(20)15-8-13(18)19/h7H,3-6,8-9H2,1-2H3,(H,15,20)(H,18,19)