ethanedioic acid; 4-[3-(4-phenyl-1,2,3-triazol-2-yl)propyl]morpholin-4-ium

Systemtic Name: ethanedioic acid; 4-[3-(4-phenyl-1,2,3-triazol-2-yl)propyl]morpholin-4-ium Openeye Name: oxalic acid; 4-[3-(4-phenyltriazol-2-yl)propyl]morpholin-4-ium CAS Name: oxalic acid; 4-[3-(4-phenyl-2-triazolyl)propyl]morpholin-4-ium IUPAC Name: oxalic acid; 4-[3-(4-phenyltriazol-2-yl)propyl]morpholin-4-ium Traditional Name: oxalic acid; 4-[3-(4-phenyltriazol-2-yl)propyl]morpholin-4-ium Formula: C17H23N4O5+ MolecularWeight: 363.38832

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN2N=CC(=N2)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1COCC[NH+]1CCCN2N=CC(=N2)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H20N4O.C2H2O4/c1-2-5-14(6-3-1)15-13-16-19(17-15)8-4-7-18-9-11-20-12-10-18;3-1(4)2(5)6/h1-3,5-6,13H,4,7-12H2;(H,3,4)(H,5,6)/p+1