1-(4-methylpiperazine-1,4-diium-1-yl)-3-(5-methyl-2-propan-2-yl-phenoxy)propan-2-ol dichloride

Systemtic Name: 1-(4-methylpiperazine-1,4-diium-1-yl)-3-(5-methyl-2-propan-2-yl-phenoxy)propan-2-ol dichloride Openeye Name: 1-(2-isopropyl-5-methyl-phenoxy)-3-(4-methylpiperazine-1,4-diium-1-yl)propan-2-ol dichloride CAS Name: 1-(4-methyl-1-piperazine-1,4-diiumyl)-3-(5-methyl-2-propan-2-ylphenoxy)-2-propanol dichloride IUPAC Name: 1-(4-methylpiperazine-1,4-diium-1-yl)-3-(5-methyl-2-propan-2-ylphenoxy)propan-2-ol dichloride Traditional Name: 1-(2-isopropyl-5-methyl-phenoxy)-3-(4-methylpiperazine-1,4-diium-1-yl)propan-2-ol dichloride Formula: C18H32Cl2N2O2 MolecularWeight: 379.36488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(C[NH+]2CC[NH+](CC2)C)O.[Cl-].[Cl-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(C[NH+]2CC[NH+](CC2)C)O.[Cl-].[Cl-]

InChI

InChI=1S/C18H30N2O2.2ClH/c1-14(2)17-6-5-15(3)11-18(17)22-13-16(21)12-20-9-7-19(4)8-10-20;;/h5-6,11,14,16,21H,7-10,12-13H2,1-4H3;2*1H