(2R)-1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-ium-1-yl]-3-(4-methoxy-2-prop-2-enyl-phenoxy)propan-2-ol

Systemtic Name: (2R)-1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-ium-1-yl]-3-(4-methoxy-2-prop-2-enyl-phenoxy)propan-2-ol Openeye Name: (2R)-1-(2-allyl-4-methoxy-phenoxy)-3-[4-(5-chloro-2-methyl-phenyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-[4-(5-chloro-2-methylphenyl)-1-piperazin-1-iumyl]-3-(4-methoxy-2-prop-2-enylphenoxy)-2-propanol IUPAC Name: (2R)-1-[4-(5-chloro-2-methylphenyl)piperazin-1-ium-1-yl]-3-(4-methoxy-2-prop-2-enylphenoxy)propan-2-ol Traditional Name: (2R)-1-(2-allyl-4-methoxy-phenoxy)-3-[4-(5-chloro-2-methyl-phenyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C24H32ClN2O3+ MolecularWeight: 431.97548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)CC(COC3=C(C=C(C=C3)OC)CC=C)O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CC[NH+](CC2)C[C@H](COC3=C(C=C(C=C3)OC)CC=C)O

InChI

InChI=1S/C24H31ClN2O3/c1-4-5-19-14-22(29-3)8-9-24(19)30-17-21(28)16-26-10-12-27(13-11-26)23-15-20(25)7-6-18(23)2/h4,6-9,14-15,21,28H,1,5,10-13,16-17H2,2-3H3/p+1/t21-/m1/s1