4-[4-(4-carbamimidoylphenyl)-1,4-diazepan-1-yl]benzenecarboximidamide dihydrochloride

Systemtic Name: 4-[4-(4-carbamimidoylphenyl)-1,4-diazepan-1-yl]benzenecarboximidamide dihydrochloride Openeye Name: 4-[4-(4-carbamimidoylphenyl)-1,4-diazepan-1-yl]benzamidine dihydrochloride CAS Name: 4-[4-(4-carbamimidoylphenyl)-1,4-diazepan-1-yl]benzenecarboximidamide dihydrochloride IUPAC Name: 4-[4-(4-carbamimidoylphenyl)-1,4-diazepan-1-yl]benzenecarboximidamide dihydrochloride Traditional Name: 4-[4-(4-amidinophenyl)-1,4-diazepan-1-yl]benzamidine dihydrochloride Formula: C19H26Cl2N6 MolecularWeight: 409.35594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=CC=C(C=C2)C(=N)N)C3=CC=C(C=C3)C(=N)N.Cl.Cl

Isomeric SMILES

C1CN(CCN(C1)C2=CC=C(C=C2)C(=N)N)C3=CC=C(C=C3)C(=N)N.Cl.Cl

InChI

InChI=1S/C19H24N6.2ClH/c20-18(21)14-2-6-16(7-3-14)24-10-1-11-25(13-12-24)17-8-4-15(5-9-17)19(22)23;;/h2-9H,1,10-13H2,(H3,20,21)(H3,22,23);2*1H