3-methyl-N,2,6-triphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-5-carboxamide

Systemtic Name: 3-methyl-N,2,6-triphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-5-carboxamide Openeye Name: 3-methyl-N,2,6-triphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-5-carboxamide CAS Name: 3-methyl-N,2,6-triphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-5-carboxamide IUPAC Name: 3-methyl-N,2,6-triphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-5-carboxamide Traditional Name: 3-methyl-N,2,6-triphenyl-1H-pyrrolo[2,1-c][1,2,4]triazol-4-ium-5-carboxamide Formula: C25H21N4O+ MolecularWeight: 393.46044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+]2C(=CC(=C2C(=O)NC3=CC=CC=C3)C4=CC=CC=C4)NN1C5=CC=CC=C5

Isomeric SMILES

CC1=[N+]2C(=CC(=C2C(=O)NC3=CC=CC=C3)C4=CC=CC=C4)NN1C5=CC=CC=C5

InChI

InChI=1S/C25H20N4O/c1-18-28-23(27-29(18)21-15-9-4-10-16-21)17-22(19-11-5-2-6-12-19)24(28)25(30)26-20-13-7-3-8-14-20/h2-17H,1H3,(H-,26,27,30)/p+1