(2R)-1-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-5-methoxy-phenoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2R)-1-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-5-methoxy-phenoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol Openeye Name: (2R)-1-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-5-methoxy-phenoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol CAS Name: (2R)-1-[2-[(4-ethyl-1-piperazin-4-iumyl)methyl]-5-methoxyphenoxy]-3-(1-pyrrolidin-1-iumyl)-2-propanol IUPAC Name: (2R)-1-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-5-methoxyphenoxy]-3-pyrrolidin-1-ium-1-ylpropan-2-ol Traditional Name: (2R)-1-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-5-methoxy-phenoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol Formula: C21H37N3O3+2 MolecularWeight: 379.53678

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=C(C=C(C=C2)OC)OCC(C[NH+]3CCCC3)O

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=C(C=C(C=C2)OC)OC[C@@H](C[NH+]3CCCC3)O

InChI

InChI=1S/C21H35N3O3/c1-3-22-10-12-24(13-11-22)15-18-6-7-20(26-2)14-21(18)27-17-19(25)16-23-8-4-5-9-23/h6-7,14,19,25H,3-5,8-13,15-17H2,1-2H3/p+2/t19-/m1/s1