N-[6-[(1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-3-ylidene)amino]hexyl]acridin-9-amine

Systemtic Name: N-[6-[(1-oxidanidyl-4-oxidanyl-1,2,4-benzotriazin-1-ium-3-ylidene)amino]hexyl]acridin-9-amine Openeye Name: N-[6-[(4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)amino]hexyl]acridin-9-amine CAS Name: N-[6-[(4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)amino]hexyl]-9-acridinamine IUPAC Name: N-[6-[(4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)amino]hexyl]acridin-9-amine Traditional Name: acridin-9-yl-[6-[(4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)amino]hexyl]amine Formula: C26H26N6O2 MolecularWeight: 454.52364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCCCCN=C4N=[N+](C5=CC=CC=C5N4O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCCCCN=C4N=[N+](C5=CC=CC=C5N4O)[O-]

InChI

InChI=1S/C26H26N6O2/c33-31-23-15-7-8-16-24(23)32(34)30-26(31)28-18-10-2-1-9-17-27-25-19-11-3-5-13-21(19)29-22-14-6-4-12-20(22)25/h3-8,11-16,33H,1-2,9-10,17-18H2,(H,27,29)