1-[4-[(2R)-3-(2-methoxy-4-prop-2-enyl-phenoxy)-2-oxidanyl-propyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 1-[4-[(2R)-3-(2-methoxy-4-prop-2-enyl-phenoxy)-2-oxidanyl-propyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-[(2R)-3-(4-allyl-2-methoxy-phenoxy)-2-hydroxy-propyl]piperazin-4-ium-1-yl]ethanone CAS Name: 1-[4-[(2R)-2-hydroxy-3-(2-methoxy-4-prop-2-enylphenoxy)propyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-[4-[(2R)-2-hydroxy-3-(2-methoxy-4-prop-2-enylphenoxy)propyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-[(2R)-3-(4-allyl-2-methoxy-phenoxy)-2-hydroxy-propyl]piperazin-4-ium-1-yl]ethanone Formula: C19H29N2O4+ MolecularWeight: 349.44456

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(COC2=C(C=C(C=C2)CC=C)OC)O

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)C[C@H](COC2=C(C=C(C=C2)CC=C)OC)O

InChI

InChI=1S/C19H28N2O4/c1-4-5-16-6-7-18(19(12-16)24-3)25-14-17(23)13-20-8-10-21(11-9-20)15(2)22/h4,6-7,12,17,23H,1,5,8-11,13-14H2,2-3H3/p+1/t17-/m1/s1