acridin-9-yl-[2-[7-(quinolin-4-ylazaniumyl)heptoxy]phenyl]azanium dichloride

Systemtic Name: acridin-9-yl-[2-[7-(quinolin-4-ylazaniumyl)heptoxy]phenyl]azanium dichloride Openeye Name: acridin-9-yl-[2-[7-(4-quinolylammonio)heptoxy]phenyl]ammonium dichloride CAS Name: 9-acridinyl-[2-[7-(4-quinolinylammonio)heptoxy]phenyl]ammonium dichloride IUPAC Name: acridin-9-yl-[2-[7-(quinolin-4-ylazaniumyl)heptoxy]phenyl]azanium dichloride Traditional Name: acridin-9-yl-[2-[7-(4-quinolylammonio)heptoxy]phenyl]ammonium dichloride Formula: C35H36Cl2N4O MolecularWeight: 599.59254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)[NH2+]CCCCCCCOC3=CC=CC=C3[NH2+]C4=C5C=CC=CC5=NC6=CC=CC=C64.[Cl-].[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)[NH2+]CCCCCCCOC3=CC=CC=C3[NH2+]C4=C5C=CC=CC5=NC6=CC=CC=C64.[Cl-].[Cl-]

InChI

InChI=1S/C35H34N4O.2ClH/c1(2-12-23-36-30-22-24-37-29-17-7-4-14-26(29)30)3-13-25-40-34-21-11-10-20-33(34)39-35-27-15-5-8-18-31(27)38-32-19-9-6-16-28(32)35;;/h4-11,14-22,24H,1-3,12-13,23,25H2,(H,36,37)(H,38,39);2*1H