(2S)-1-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-3-(2-methylbut-3-en-2-yloxy)propan-2-ol

Systemtic Name: (2S)-1-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-3-(2-methylbut-3-en-2-yloxy)propan-2-ol Openeye Name: (2S)-1-(1,1-dimethylallyloxy)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2S)-1-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-3-(2-methylbut-3-en-2-yloxy)-2-propanol IUPAC Name: (2S)-1-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-3-(2-methylbut-3-en-2-yloxy)propan-2-ol Traditional Name: (2S)-1-(1,1-dimethylallyloxy)-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C19H31N2O3+ MolecularWeight: 335.46104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=C)OCC(C[NH+]1CCN(CC1)C2=CC=CC=C2OC)O

Isomeric SMILES

CC(C)(C=C)OC[C@H](C[NH+]1CCN(CC1)C2=CC=CC=C2OC)O

InChI

InChI=1S/C19H30N2O3/c1-5-19(2,3)24-15-16(22)14-20-10-12-21(13-11-20)17-8-6-7-9-18(17)23-4/h5-9,16,22H,1,10-15H2,2-4H3/p+1/t16-/m0/s1