4-methyl-2,4,5,7-tetraphenyl-3H-1,2,4-benzotriazine-2,4-diium

Systemtic Name: 4-methyl-2,4,5,7-tetraphenyl-3H-1,2,4-benzotriazine-2,4-diium Openeye Name: 4-methyl-2,4,5,7-tetraphenyl-3H-1,2,4-benzotriazine-2,4-diium CAS Name: 4-methyl-2,4,5,7-tetraphenyl-3H-1,2,4-benzotriazine-2,4-diium IUPAC Name: 4-methyl-2,4,5,7-tetraphenyl-3H-1,2,4-benzotriazine-2,4-diium Traditional Name: 4-methyl-2,4,5,7-tetraphenyl-3H-1,2,4-benzotriazine-2,4-diium Formula: C32H27N3+2 MolecularWeight: 453.57688

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C[N+](=NC2=CC(=CC(=C21)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C[N+]1(C[N+](=NC2=CC(=CC(=C21)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H27N3/c1-35(29-20-12-5-13-21-29)24-34(28-18-10-4-11-19-28)33-31-23-27(25-14-6-2-7-15-25)22-30(32(31)35)26-16-8-3-9-17-26/h2-23H,24H2,1H3/q+2