5-ethanoyl-1-[3-(5-ethanoyl-4-oxidanidyl-3-phenyl-1,2,3-triazol-1-ium-1-yl)-2-oxidanyl-propyl]-3-phenyl-1,2,3-triazol-1-ium-4-olate

Systemtic Name: 5-ethanoyl-1-[3-(5-ethanoyl-4-oxidanidyl-3-phenyl-1,2,3-triazol-1-ium-1-yl)-2-oxidanyl-propyl]-3-phenyl-1,2,3-triazol-1-ium-4-olate Openeye Name: 5-acetyl-1-[3-(5-acetyl-4-oxido-3-phenyl-triazol-1-ium-1-yl)-2-hydroxy-propyl]-3-phenyl-triazol-1-ium-4-olate CAS Name: 5-acetyl-1-[3-(5-acetyl-4-oxido-3-phenyl-1-triazol-1-iumyl)-2-hydroxypropyl]-3-phenyl-4-triazol-1-iumolate IUPAC Name: 5-acetyl-1-[3-(5-acetyl-4-oxido-3-phenyltriazol-1-ium-1-yl)-2-hydroxypropyl]-3-phenyltriazol-1-ium-4-olate Traditional Name: 5-acetyl-1-[3-(5-acetyl-4-oxido-3-phenyl-triazol-1-ium-1-yl)-2-hydroxy-propyl]-3-phenyl-triazol-1-ium-4-olate Formula: C23H22N6O5 MolecularWeight: 462.45798

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(N=[N+]1CC(C[N+]2=NN(C(=C2C(=O)C)[O-])C3=CC=CC=C3)O)C4=CC=CC=C4)[O-]

Isomeric SMILES

CC(=O)C1=C(N(N=[N+]1CC(C[N+]2=NN(C(=C2C(=O)C)[O-])C3=CC=CC=C3)O)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C23H22N6O5/c1-15(30)20-22(33)28(17-9-5-3-6-10-17)24-26(20)13-19(32)14-27-21(16(2)31)23(34)29(25-27)18-11-7-4-8-12-18/h3-12,19,32H,13-14H2,1-2H3