N-[4-(acridin-9-ylamino)phenyl]hexane-1-sulfonamide dihydrate hydrochloride

Systemtic Name: N-[4-(acridin-9-ylamino)phenyl]hexane-1-sulfonamide dihydrate hydrochloride Openeye Name: N-[4-(acridin-9-ylamino)phenyl]hexane-1-sulfonamide dihydrate hydrochloride CAS Name: N-[4-(9-acridinylamino)phenyl]-1-hexanesulfonamide dihydrate hydrochloride IUPAC Name: N-[4-(acridin-9-ylamino)phenyl]hexane-1-sulfonamide dihydrate hydrochloride Traditional Name: N-[4-(acridin-9-ylamino)phenyl]hexane-1-sulfonamide dihydrate hydrochloride Formula: C25H32ClN3O4S MolecularWeight: 506.05728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42.O.O.Cl

Isomeric SMILES

CCCCCCS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42.O.O.Cl

InChI

InChI=1S/C25H27N3O2S.ClH.2H2O/c1-2-3-4-9-18-31(29,30)28-20-16-14-19(15-17-20)26-25-21-10-5-7-12-23(21)27-24-13-8-6-11-22(24)25;;;/h5-8,10-17,28H,2-4,9,18H2,1H3,(H,26,27);1H;2*1H2