2,5-diphenyl-4H-pyrido[3,2-e][1,2,4]triazepin-6-ium

Systemtic Name: 2,5-diphenyl-4H-pyrido[3,2-e][1,2,4]triazepin-6-ium Openeye Name: 2,5-diphenyl-4H-pyrido[3,2-e][1,2,4]triazepin-6-ium CAS Name: 2,5-diphenyl-4H-pyrido[3,2-e][1,2,4]triazepin-6-ium IUPAC Name: 2,5-diphenyl-4H-pyrido[3,2-e][1,2,4]triazepin-6-ium Traditional Name: 2,5-diphenyl-4H-pyrido[3,2-e][1,2,4]triazepin-6-ium Formula: C19H15N4+ MolecularWeight: 299.3492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C(=NC(=NN2)C4=CC=CC=C4)C=CC=[NH+]3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C(=NC(=NN2)C4=CC=CC=C4)C=CC=[NH+]3

InChI

InChI=1S/C19H14N4/c1-3-8-14(9-4-1)17-18-16(12-7-13-20-18)21-19(23-22-17)15-10-5-2-6-11-15/h1-13,22H/p+1