5-[(3-morpholin-4-ylpropylazaniumyl)methyl]furan-2-carboxylate

Systemtic Name: 5-[(3-morpholin-4-ylpropylazaniumyl)methyl]furan-2-carboxylate Openeye Name: 5-[(3-morpholinopropylammonio)methyl]furan-2-carboxylate CAS Name: 5-[[3-(4-morpholinyl)propylammonio]methyl]-2-furancarboxylate IUPAC Name: 5-[(3-morpholin-4-ylpropylazaniumyl)methyl]furan-2-carboxylate Traditional Name: 5-[(3-morpholinopropylammonio)methyl]-2-furoate Formula: C13H20N2O4 MolecularWeight: 268.3089

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCC[NH2+]CC2=CC=C(O2)C(=O)[O-]

Isomeric SMILES

C1COCCN1CCC[NH2+]CC2=CC=C(O2)C(=O)[O-]

InChI

InChI=1S/C13H20N2O4/c16-13(17)12-3-2-11(19-12)10-14-4-1-5-15-6-8-18-9-7-15/h2-3,14H,1,4-10H2,(H,16,17)