N'-(5-azanyl-6-oxidanyl-6-phenyl-hexyl)ethanimidamide dihydrate hydrochloride

Systemtic Name: N'-(5-azanyl-6-oxidanyl-6-phenyl-hexyl)ethanimidamide dihydrate hydrochloride Openeye Name: N'-(5-amino-6-hydroxy-6-phenyl-hexyl)acetamidine dihydrate hydrochloride CAS Name: N'-(5-amino-6-hydroxy-6-phenylhexyl)ethanimidamide dihydrate hydrochloride IUPAC Name: N'-(5-amino-6-hydroxy-6-phenylhexyl)ethanimidamide dihydrate hydrochloride Traditional Name: N'-(5-amino-6-hydroxy-6-phenyl-hexyl)acetamidine dihydrate hydrochloride Formula: C14H28ClN3O3 MolecularWeight: 321.84342

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCCCCC(C(C1=CC=CC=C1)O)N)N.O.O.Cl

Isomeric SMILES

CC(=NCCCCC(C(C1=CC=CC=C1)O)N)N.O.O.Cl

InChI

InChI=1S/C14H23N3O.ClH.2H2O/c1-11(15)17-10-6-5-9-13(16)14(18)12-7-3-2-4-8-12;;;/h2-4,7-8,13-14,18H,5-6,9-10,16H2,1H3,(H2,15,17);1H;2*1H2