1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-(2,4,6-trimethylphenoxy)propan-2-ol

Systemtic Name: 1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-(2,4,6-trimethylphenoxy)propan-2-ol Openeye Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-3-(2,4,6-trimethylphenoxy)propan-2-ol CAS Name: 1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-(2,4,6-trimethylphenoxy)-2-propanol IUPAC Name: 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-(2,4,6-trimethylphenoxy)propan-2-ol Traditional Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazino]-3-(2,4,6-trimethylphenoxy)propan-2-ol Formula: C23H31ClN2O2 MolecularWeight: 402.95744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(COC3=C(C=C(C=C3C)C)C)O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(COC3=C(C=C(C=C3C)C)C)O

InChI

InChI=1S/C23H31ClN2O2/c1-16-11-18(3)23(19(4)12-16)28-15-21(27)14-25-7-9-26(10-8-25)22-13-20(24)6-5-17(22)2/h5-6,11-13,21,27H,7-10,14-15H2,1-4H3