4-[4-(phenylmethyl)piperazin-1-yl]-1H-indole hydrate dihydrochloride

Systemtic Name: 4-[4-(phenylmethyl)piperazin-1-yl]-1H-indole hydrate dihydrochloride Openeye Name: 4-(4-benzylpiperazin-1-yl)-1H-indole hydrate dihydrochloride CAS Name: 4-[4-(phenylmethyl)-1-piperazinyl]-1H-indole hydrate dihydrochloride IUPAC Name: 4-(4-benzylpiperazin-1-yl)-1H-indole hydrate dihydrochloride Traditional Name: 4-(4-benzylpiperazino)-1H-indole hydrate dihydrochloride Formula: C19H25Cl2N3O MolecularWeight: 382.3273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=CC4=C3C=CN4.O.Cl.Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=CC4=C3C=CN4.O.Cl.Cl

InChI

InChI=1S/C19H21N3.2ClH.H2O/c1-2-5-16(6-3-1)15-21-11-13-22(14-12-21)19-8-4-7-18-17(19)9-10-20-18;;;/h1-10,20H,11-15H2;2*1H;1H2