2-bromanyl-4-[3-(4-carbamimidoylphenoxy)propoxy]benzenecarboximidamide dihydrochloride

Systemtic Name: 2-bromanyl-4-[3-(4-carbamimidoylphenoxy)propoxy]benzenecarboximidamide dihydrochloride Openeye Name: 2-bromo-4-[3-(4-carbamimidoylphenoxy)propoxy]benzamidine dihydrochloride CAS Name: 2-bromo-4-[3-(4-carbamimidoylphenoxy)propoxy]benzenecarboximidamide dihydrochloride IUPAC Name: 2-bromo-4-[3-(4-carbamimidoylphenoxy)propoxy]benzenecarboximidamide dihydrochloride Traditional Name: 4-[3-(4-amidinophenoxy)propoxy]-2-bromo-benzamidine dihydrochloride Formula: C17H21BrCl2N4O2 MolecularWeight: 464.18424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=N)N)OCCCOC2=CC(=C(C=C2)C(=N)N)Br.Cl.Cl

Isomeric SMILES

C1=CC(=CC=C1C(=N)N)OCCCOC2=CC(=C(C=C2)C(=N)N)Br.Cl.Cl

InChI

InChI=1S/C17H19BrN4O2.2ClH/c18-15-10-13(6-7-14(15)17(21)22)24-9-1-8-23-12-4-2-11(3-5-12)16(19)20;;/h2-7,10H,1,8-9H2,(H3,19,20)(H3,21,22);2*1H