(2R)-1-(2-methoxy-4-prop-2-enyl-phenoxy)-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol

Systemtic Name: (2R)-1-(2-methoxy-4-prop-2-enyl-phenoxy)-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol Openeye Name: (2R)-1-(4-allyl-2-methoxy-phenoxy)-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2R)-1-(2-methoxy-4-prop-2-enylphenoxy)-3-(4-methyl-1-piperazin-4-iumyl)-2-propanol IUPAC Name: (2R)-1-(2-methoxy-4-prop-2-enylphenoxy)-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol Traditional Name: (2R)-1-(4-allyl-2-methoxy-phenoxy)-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol Formula: C18H29N2O3+ MolecularWeight: 321.43446

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC(COC2=C(C=C(C=C2)CC=C)OC)O

Isomeric SMILES

C[NH+]1CCN(CC1)C[C@H](COC2=C(C=C(C=C2)CC=C)OC)O

InChI

InChI=1S/C18H28N2O3/c1-4-5-15-6-7-17(18(12-15)22-3)23-14-16(21)13-20-10-8-19(2)9-11-20/h4,6-7,12,16,21H,1,5,8-11,13-14H2,2-3H3/p+1/t16-/m1/s1