N-[2-[2-[(1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-yl)amino]ethoxy]ethyl]acridine-4-carboxamide

Systemtic Name: N-[2-[2-[(1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-yl)amino]ethoxy]ethyl]acridine-4-carboxamide Openeye Name: N-[2-[2-[(1-oxido-1,2,4-benzotriazin-1-ium-3-yl)amino]ethoxy]ethyl]acridine-4-carboxamide CAS Name: N-[2-[2-[(1-oxido-1,2,4-benzotriazin-1-ium-3-yl)amino]ethoxy]ethyl]-4-acridinecarboxamide IUPAC Name: N-[2-[2-[(1-oxido-1,2,4-benzotriazin-1-ium-3-yl)amino]ethoxy]ethyl]acridine-4-carboxamide Traditional Name: N-[2-[2-[(1-oxido-1,2,4-benzotriazin-1-ium-3-yl)amino]ethoxy]ethyl]acridine-4-carboxamide Formula: C25H22N6O3 MolecularWeight: 454.48058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=C(C3=N2)C(=O)NCCOCCNC4=NC5=CC=CC=C5[N+](=N4)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=C(C3=N2)C(=O)NCCOCCNC4=NC5=CC=CC=C5[N+](=N4)[O-]

InChI

InChI=1S/C25H22N6O3/c32-24(19-8-5-7-18-16-17-6-1-2-9-20(17)28-23(18)19)26-12-14-34-15-13-27-25-29-21-10-3-4-11-22(21)31(33)30-25/h1-11,16H,12-15H2,(H,26,32)(H,27,29,30)