N-[2-[4-(quinolin-4-ylamino)butoxy]phenyl]acridin-9-amine dihydrate dihydrochloride

Systemtic Name: N-[2-[4-(quinolin-4-ylamino)butoxy]phenyl]acridin-9-amine dihydrate dihydrochloride Openeye Name: N-[2-[4-(4-quinolylamino)butoxy]phenyl]acridin-9-amine dihydrate dihydrochloride CAS Name: N-[2-[4-(4-quinolinylamino)butoxy]phenyl]-9-acridinamine dihydrate dihydrochloride IUPAC Name: N-[2-[4-(quinolin-4-ylamino)butoxy]phenyl]acridin-9-amine dihydrate dihydrochloride Traditional Name: acridin-9-yl-[2-[4-(4-quinolylamino)butoxy]phenyl]amine dihydrate dihydrochloride Formula: C32H34Cl2N4O3 MolecularWeight: 593.54336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)NCCCCOC3=CC=CC=C3NC4=C5C=CC=CC5=NC6=CC=CC=C64.O.O.Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)NCCCCOC3=CC=CC=C3NC4=C5C=CC=CC5=NC6=CC=CC=C64.O.O.Cl.Cl

InChI

InChI=1S/C32H28N4O.2ClH.2H2O/c1-4-14-26-23(11-1)27(19-21-34-26)33-20-9-10-22-37-31-18-8-7-17-30(31)36-32-24-12-2-5-15-28(24)35-29-16-6-3-13-25(29)32;;;;/h1-8,11-19,21H,9-10,20,22H2,(H,33,34)(H,35,36);2*1H;2*1H2