N-[2-[6-(quinolin-4-ylamino)hexoxy]phenyl]acridin-9-amine hydrate dihydrochloride

Systemtic Name: N-[2-[6-(quinolin-4-ylamino)hexoxy]phenyl]acridin-9-amine hydrate dihydrochloride Openeye Name: N-[2-[6-(4-quinolylamino)hexoxy]phenyl]acridin-9-amine hydrate dihydrochloride CAS Name: N-[2-[6-(4-quinolinylamino)hexoxy]phenyl]-9-acridinamine hydrate dihydrochloride IUPAC Name: N-[2-[6-(quinolin-4-ylamino)hexoxy]phenyl]acridin-9-amine hydrate dihydrochloride Traditional Name: acridin-9-yl-[2-[6-(4-quinolylamino)hexoxy]phenyl]amine hydrate dihydrochloride Formula: C34H36Cl2N4O2 MolecularWeight: 603.58124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)NCCCCCCOC3=CC=CC=C3NC4=C5C=CC=CC5=NC6=CC=CC=C64.O.Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)NCCCCCCOC3=CC=CC=C3NC4=C5C=CC=CC5=NC6=CC=CC=C64.O.Cl.Cl

InChI

InChI=1S/C34H32N4O.2ClH.H2O/c1(11-22-35-29-21-23-36-28-16-6-3-13-25(28)29)2-12-24-39-33-20-10-9-19-32(33)38-34-26-14-4-7-17-30(26)37-31-18-8-5-15-27(31)34;;;/h3-10,13-21,23H,1-2,11-12,22,24H2,(H,35,36)(H,37,38);2*1H;1H2