2-cyclohexyl-N-[4-(4-methylpiperazin-1-yl)but-2-ynyl]-2-oxidanyl-2-phenyl-ethanamide dihydrochloride

Systemtic Name: 2-cyclohexyl-N-[4-(4-methylpiperazin-1-yl)but-2-ynyl]-2-oxidanyl-2-phenyl-ethanamide dihydrochloride Openeye Name: 2-cyclohexyl-2-hydroxy-N-[4-(4-methylpiperazin-1-yl)but-2-ynyl]-2-phenyl-acetamide dihydrochloride CAS Name: 2-cyclohexyl-2-hydroxy-N-[4-(4-methyl-1-piperazinyl)but-2-ynyl]-2-phenylacetamide dihydrochloride IUPAC Name: 2-cyclohexyl-2-hydroxy-N-[4-(4-methylpiperazin-1-yl)but-2-ynyl]-2-phenylacetamide dihydrochloride Traditional Name: 2-cyclohexyl-2-hydroxy-N-[4-(4-methylpiperazino)but-2-ynyl]-2-phenyl-acetamide dihydrochloride Formula: C23H35Cl2N3O2 MolecularWeight: 456.4489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC#CCNC(=O)C(C2CCCCC2)(C3=CC=CC=C3)O.Cl.Cl

Isomeric SMILES

CN1CCN(CC1)CC#CCNC(=O)C(C2CCCCC2)(C3=CC=CC=C3)O.Cl.Cl

InChI

InChI=1S/C23H33N3O2.2ClH/c1-25-16-18-26(19-17-25)15-9-8-14-24-22(27)23(28,20-10-4-2-5-11-20)21-12-6-3-7-13-21;;/h2,4-5,10-11,21,28H,3,6-7,12-19H2,1H3,(H,24,27);2*1H