ethyl 2-(1-oxidanidyl-4,5-diphenyl-1,3,5-triazine-1,5-diium-2-yl)propanoate

Systemtic Name: ethyl 2-(1-oxidanidyl-4,5-diphenyl-1,3,5-triazine-1,5-diium-2-yl)propanoate Openeye Name: ethyl 2-(1-oxido-4,5-diphenyl-1,3,5-triazine-1,5-diium-2-yl)propanoate CAS Name: 2-(1-oxido-4,5-diphenyl-1,3,5-triazine-1,5-diium-2-yl)propanoic acid ethyl ester IUPAC Name: ethyl 2-(1-oxido-4,5-diphenyl-1,3,5-triazine-1,5-diium-2-yl)propanoate Traditional Name: 2-(1-oxido-4,5-diphenyl-s-triazine-1,5-diium-2-yl)propionic acid ethyl ester Formula: C20H20N3O3+ MolecularWeight: 350.3911

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C1=[N+](C=[N+](C(=N1)C2=CC=CC=C2)C3=CC=CC=C3)[O-]

Isomeric SMILES

CCOC(=O)C(C)C1=[N+](C=[N+](C(=N1)C2=CC=CC=C2)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C20H20N3O3/c1-3-26-20(24)15(2)18-21-19(16-10-6-4-7-11-16)22(14-23(18)25)17-12-8-5-9-13-17/h4-15H,3H2,1-2H3/q+1