(2R)-2-(4-ethylphenoxy)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)propan-1-one

Systemtic Name: (2R)-2-(4-ethylphenoxy)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)propan-1-one Openeye Name: (2R)-1-(4-allylpiperazin-4-ium-1-yl)-2-(4-ethylphenoxy)propan-1-one CAS Name: (2R)-2-(4-ethylphenoxy)-1-(4-prop-2-enyl-1-piperazin-4-iumyl)-1-propanone IUPAC Name: (2R)-2-(4-ethylphenoxy)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)propan-1-one Traditional Name: (2R)-1-(4-allylpiperazin-4-ium-1-yl)-2-(4-ethylphenoxy)propan-1-one Formula: C18H27N2O2+ MolecularWeight: 303.41918

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC(C)C(=O)N2CC[NH+](CC2)CC=C

Isomeric SMILES

CCC1=CC=C(C=C1)O[C@H](C)C(=O)N2CC[NH+](CC2)CC=C

InChI

InChI=1S/C18H26N2O2/c1-4-10-19-11-13-20(14-12-19)18(21)15(3)22-17-8-6-16(5-2)7-9-17/h4,6-9,15H,1,5,10-14H2,2-3H3/p+1/t15-/m1/s1