(2S)-1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-prop-2-enoxy-propan-2-ol

Systemtic Name: (2S)-1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-prop-2-enoxy-propan-2-ol Openeye Name: (2S)-1-allyloxy-3-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]propan-2-ol CAS Name: (2S)-1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-prop-2-enoxy-2-propanol IUPAC Name: (2S)-1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-prop-2-enoxypropan-2-ol Traditional Name: (2S)-1-allyloxy-3-[4-(5-chloro-2-methyl-phenyl)piperazino]propan-2-ol Formula: C17H25ClN2O2 MolecularWeight: 324.8456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(COCC=C)O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C[C@@H](COCC=C)O

InChI

InChI=1S/C17H25ClN2O2/c1-3-10-22-13-16(21)12-19-6-8-20(9-7-19)17-11-15(18)5-4-14(17)2/h3-5,11,16,21H,1,6-10,12-13H2,2H3/t16-/m0/s1