(2,4,6-trimethylphenyl) 2-(4-methylpiperazin-1-yl)propanoate dihydrochloride

Systemtic Name: (2,4,6-trimethylphenyl) 2-(4-methylpiperazin-1-yl)propanoate dihydrochloride Openeye Name: (2,4,6-trimethylphenyl) 2-(4-methylpiperazin-1-yl)propanoate dihydrochloride CAS Name: 2-(4-methyl-1-piperazinyl)propanoic acid (2,4,6-trimethylphenyl) ester dihydrochloride IUPAC Name: (2,4,6-trimethylphenyl) 2-(4-methylpiperazin-1-yl)propanoate dihydrochloride Traditional Name: 2-(4-methylpiperazino)propionic acid mesityl ester dihydrochloride Formula: C17H28Cl2N2O2 MolecularWeight: 363.32242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OC(=O)C(C)N2CCN(CC2)C)C.Cl.Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OC(=O)C(C)N2CCN(CC2)C)C.Cl.Cl

InChI

InChI=1S/C17H26N2O2.2ClH/c1-12-10-13(2)16(14(3)11-12)21-17(20)15(4)19-8-6-18(5)7-9-19;;/h10-11,15H,6-9H2,1-5H3;2*1H