N-[2-[5-(quinolin-4-ylamino)pentoxy]phenyl]acridin-9-amine hydrate dihydrochloride

Systemtic Name: N-[2-[5-(quinolin-4-ylamino)pentoxy]phenyl]acridin-9-amine hydrate dihydrochloride Openeye Name: N-[2-[5-(4-quinolylamino)pentoxy]phenyl]acridin-9-amine hydrate dihydrochloride CAS Name: N-[2-[5-(4-quinolinylamino)pentoxy]phenyl]-9-acridinamine hydrate dihydrochloride IUPAC Name: N-[2-[5-(quinolin-4-ylamino)pentoxy]phenyl]acridin-9-amine hydrate dihydrochloride Traditional Name: acridin-9-yl-[2-[5-(4-quinolylamino)pentoxy]phenyl]amine hydrate dihydrochloride Formula: C33H34Cl2N4O2 MolecularWeight: 589.55466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)NCCCCCOC3=CC=CC=C3NC4=C5C=CC=CC5=NC6=CC=CC=C64.O.Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)NCCCCCOC3=CC=CC=C3NC4=C5C=CC=CC5=NC6=CC=CC=C64.O.Cl.Cl

InChI

InChI=1S/C33H30N4O.2ClH.H2O/c1(10-21-34-28-20-22-35-27-15-5-2-12-24(27)28)11-23-38-32-19-9-8-18-31(32)37-33-25-13-3-6-16-29(25)36-30-17-7-4-14-26(30)33;;;/h2-9,12-20,22H,1,10-11,21,23H2,(H,34,35)(H,36,37);2*1H;1H2