N'-cyclooctyl-4-[4-[4-(N'-cyclooctylcarbamimidoyl)phenyl]piperazin-1-yl]benzenecarboximidamide dihydrochloride

Systemtic Name: N'-cyclooctyl-4-[4-[4-(N'-cyclooctylcarbamimidoyl)phenyl]piperazin-1-yl]benzenecarboximidamide dihydrochloride Openeye Name: N'-cyclooctyl-4-[4-[4-(N'-cyclooctylcarbamimidoyl)phenyl]piperazin-1-yl]benzamidine dihydrochloride CAS Name: 4-[4-[4-[amino(cyclooctylimino)methyl]phenyl]-1-piperazinyl]-N'-cyclooctylbenzenecarboximidamide dihydrochloride IUPAC Name: N'-cyclooctyl-4-[4-[4-(N'-cyclooctylcarbamimidoyl)phenyl]piperazin-1-yl]benzenecarboximidamide dihydrochloride Traditional Name: N'-cyclooctyl-4-[4-[4-(N'-cyclooctylamidino)phenyl]piperazino]benzamidine dihydrochloride Formula: C34H52Cl2N6 MolecularWeight: 615.72288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)N=C(C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)C(=NC5CCCCCCC5)N)N.Cl.Cl

Isomeric SMILES

C1CCCC(CCC1)N=C(C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)C(=NC5CCCCCCC5)N)N.Cl.Cl

InChI

InChI=1S/C34H50N6.2ClH/c35-33(37-29-11-7-3-1-4-8-12-29)27-15-19-31(20-16-27)39-23-25-40(26-24-39)32-21-17-28(18-22-32)34(36)38-30-13-9-5-2-6-10-14-30;;/h15-22,29-30H,1-14,23-26H2,(H2,35,37)(H2,36,38);2*1H