acridin-9-yl-[2-[8-(quinolin-4-ylazaniumyl)octoxy]phenyl]azanium dichloride

Systemtic Name: acridin-9-yl-[2-[8-(quinolin-4-ylazaniumyl)octoxy]phenyl]azanium dichloride Openeye Name: acridin-9-yl-[2-[8-(4-quinolylammonio)octoxy]phenyl]ammonium dichloride CAS Name: 9-acridinyl-[2-[8-(4-quinolinylammonio)octoxy]phenyl]ammonium dichloride IUPAC Name: acridin-9-yl-[2-[8-(quinolin-4-ylazaniumyl)octoxy]phenyl]azanium dichloride Traditional Name: acridin-9-yl-[2-[8-(4-quinolylammonio)octoxy]phenyl]ammonium dichloride Formula: C36H38Cl2N4O MolecularWeight: 613.61912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)[NH2+]CCCCCCCCOC3=CC=CC=C3[NH2+]C4=C5C=CC=CC5=NC6=CC=CC=C64.[Cl-].[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)[NH2+]CCCCCCCCOC3=CC=CC=C3[NH2+]C4=C5C=CC=CC5=NC6=CC=CC=C64.[Cl-].[Cl-]

InChI

InChI=1S/C36H36N4O.2ClH/c1(3-13-24-37-31-23-25-38-30-18-8-5-15-27(30)31)2-4-14-26-41-35-22-12-11-21-34(35)40-36-28-16-6-9-19-32(28)39-33-20-10-7-17-29(33)36;;/h5-12,15-23,25H,1-4,13-14,24,26H2,(H,37,38)(H,39,40);2*1H