N-[2-[2-[(1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-3-ylidene)amino]ethylamino]ethyl]-2-pyridin-4-yl-quinoline-8-carboxamide

Systemtic Name: N-[2-[2-[(1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-3-ylidene)amino]ethylamino]ethyl]-2-pyridin-4-yl-quinoline-8-carboxamide Openeye Name: N-[2-[2-[(4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)amino]ethylamino]ethyl]-2-(4-pyridyl)quinoline-8-carboxamide CAS Name: N-[2-[2-[(4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)amino]ethylamino]ethyl]-2-pyridin-4-yl-8-quinolinecarboxamide IUPAC Name: N-[2-[2-[(4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)amino]ethylamino]ethyl]-2-pyridin-4-ylquinoline-8-carboxamide Traditional Name: N-[2-[2-[(4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)amino]ethylamino]ethyl]-2-(4-pyridyl)quinoline-8-carboxamide Formula: C26H24N8O3 MolecularWeight: 496.52056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=NCCNCCNC(=O)C3=CC=CC4=C3N=C(C=C4)C5=CC=NC=C5)N=[N+]2[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=NCCNCCNC(=O)C3=CC=CC4=C3N=C(C=C4)C5=CC=NC=C5)N=[N+]2[O-])O

InChI

InChI=1S/C26H24N8O3/c35-25(20-5-3-4-19-8-9-21(31-24(19)20)18-10-12-27-13-11-18)29-16-14-28-15-17-30-26-32-34(37)23-7-2-1-6-22(23)33(26)36/h1-13,28,36H,14-17H2,(H,29,35)