N-(4-cyclopentylphenyl)-4-methyl-2-(4-methylpiperazin-1-yl)pentanamide hydrate dihydrochloride

Systemtic Name: N-(4-cyclopentylphenyl)-4-methyl-2-(4-methylpiperazin-1-yl)pentanamide hydrate dihydrochloride Openeye Name: N-(4-cyclopentylphenyl)-4-methyl-2-(4-methylpiperazin-1-yl)pentanamide hydrate dihydrochloride CAS Name: N-(4-cyclopentylphenyl)-4-methyl-2-(4-methyl-1-piperazinyl)pentanamide hydrate dihydrochloride IUPAC Name: N-(4-cyclopentylphenyl)-4-methyl-2-(4-methylpiperazin-1-yl)pentanamide hydrate dihydrochloride Traditional Name: N-(4-cyclopentylphenyl)-4-methyl-2-(4-methylpiperazino)valeramide hydrate dihydrochloride Formula: C22H39Cl2N3O2 MolecularWeight: 448.46996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=C(C=C1)C2CCCC2)N3CCN(CC3)C.O.Cl.Cl

Isomeric SMILES

CC(C)CC(C(=O)NC1=CC=C(C=C1)C2CCCC2)N3CCN(CC3)C.O.Cl.Cl

InChI

InChI=1S/C22H35N3O.2ClH.H2O/c1-17(2)16-21(25-14-12-24(3)13-15-25)22(26)23-20-10-8-19(9-11-20)18-6-4-5-7-18;;;/h8-11,17-18,21H,4-7,12-16H2,1-3H3,(H,23,26);2*1H;1H2