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

Systemtic Name: (2S)-1-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-3-propan-2-yloxy-propan-2-ol Openeye Name: (2S)-1-isopropoxy-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol CAS Name: (2S)-1-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-3-propan-2-yloxy-2-propanol IUPAC Name: (2S)-1-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-3-propan-2-yloxypropan-2-ol Traditional Name: (2S)-1-isopropoxy-3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propan-2-ol Formula: C17H29N2O3+ MolecularWeight: 309.42376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2O3/c1-14(2)22-13-15(20)12-18-8-10-19(11-9-18)16-6-4-5-7-17(16)21-3/h4-7,14-15,20H,8-13H2,1-3H3/p+1/t15-/m0/s1