4-[4-(4-carbamimidoylphenoxy)-3-oxidanyl-butoxy]benzenecarboximidamide dihydrochloride

Systemtic Name: 4-[4-(4-carbamimidoylphenoxy)-3-oxidanyl-butoxy]benzenecarboximidamide dihydrochloride Openeye Name: 4-[4-(4-carbamimidoylphenoxy)-3-hydroxy-butoxy]benzamidine dihydrochloride CAS Name: 4-[4-(4-carbamimidoylphenoxy)-3-hydroxybutoxy]benzenecarboximidamide dihydrochloride IUPAC Name: 4-[4-(4-carbamimidoylphenoxy)-3-hydroxybutoxy]benzenecarboximidamide dihydrochloride Traditional Name: 4-[4-(4-amidinophenoxy)-3-hydroxy-butoxy]benzamidine dihydrochloride Formula: C18H24Cl2N4O3 MolecularWeight: 415.31416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=N)N)OCCC(COC2=CC=C(C=C2)C(=N)N)O.Cl.Cl

Isomeric SMILES

C1=CC(=CC=C1C(=N)N)OCCC(COC2=CC=C(C=C2)C(=N)N)O.Cl.Cl

InChI

InChI=1S/C18H22N4O3.2ClH/c19-17(20)12-1-5-15(6-2-12)24-10-9-14(23)11-25-16-7-3-13(4-8-16)18(21)22;;/h1-8,14,23H,9-11H2,(H3,19,20)(H3,21,22);2*1H