(2R)-2-[[5-[(4-ethylpiperazin-1-ium-1-yl)methyl]furan-2-yl]carbonylamino]propanoate

Systemtic Name: (2R)-2-[[5-[(4-ethylpiperazin-1-ium-1-yl)methyl]furan-2-yl]carbonylamino]propanoate Openeye Name: (2R)-2-[[5-[(4-ethylpiperazin-1-ium-1-yl)methyl]furan-2-carbonyl]amino]propanoate CAS Name: (2R)-2-[[[5-[(4-ethyl-1-piperazin-1-iumyl)methyl]-2-furanyl]-oxomethyl]amino]propanoate IUPAC Name: (2R)-2-[[5-[(4-ethylpiperazin-1-ium-1-yl)methyl]furan-2-carbonyl]amino]propanoate Traditional Name: (2R)-2-[[5-[(4-ethylpiperazin-1-ium-1-yl)methyl]-2-furoyl]amino]propionate Formula: C15H23N3O4 MolecularWeight: 309.36082

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)CC2=CC=C(O2)C(=O)NC(C)C(=O)[O-]

Isomeric SMILES

CCN1CC[NH+](CC1)CC2=CC=C(O2)C(=O)N[C@H](C)C(=O)[O-]

InChI

InChI=1S/C15H23N3O4/c1-3-17-6-8-18(9-7-17)10-12-4-5-13(22-12)14(19)16-11(2)15(20)21/h4-5,11H,3,6-10H2,1-2H3,(H,16,19)(H,20,21)/t11-/m1/s1