1,3-bis(phenylmethyl)-5-[(phenylmethyl)carbamoyl]-1,2,3-triazol-3-ium-4-olate

Systemtic Name: 1,3-bis(phenylmethyl)-5-[(phenylmethyl)carbamoyl]-1,2,3-triazol-3-ium-4-olate Openeye Name: 1,3-dibenzyl-5-(benzylcarbamoyl)triazol-3-ium-4-olate CAS Name: 5-[oxo-[(phenylmethyl)amino]methyl]-1,3-bis(phenylmethyl)-4-triazol-3-iumolate IUPAC Name: 1,3-dibenzyl-5-(benzylcarbamoyl)triazol-3-ium-4-olate Traditional Name: 1,3-dibenzyl-5-(benzylcarbamoyl)triazol-3-ium-4-olate Formula: C24H22N4O2 MolecularWeight: 398.45708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=C([N+](=NN2CC3=CC=CC=C3)CC4=CC=CC=C4)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=C([N+](=NN2CC3=CC=CC=C3)CC4=CC=CC=C4)[O-]

InChI

InChI=1S/C24H22N4O2/c29-23(25-16-19-10-4-1-5-11-19)22-24(30)28(18-21-14-8-3-9-15-21)26-27(22)17-20-12-6-2-7-13-20/h1-15H,16-18H2,(H-,25,26,29,30)