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

Systemtic Name: (2R)-1-[5-[(4-cyclopentylpiperazin-4-ium-1-yl)methyl]-2-methoxy-phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol Openeye Name: (2R)-1-[5-[(4-cyclopentylpiperazin-4-ium-1-yl)methyl]-2-methoxy-phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol CAS Name: (2R)-1-[5-[(4-cyclopentyl-1-piperazin-4-iumyl)methyl]-2-methoxyphenoxy]-3-(1-piperidin-1-iumyl)-2-propanol IUPAC Name: (2R)-1-[5-[(4-cyclopentylpiperazin-4-ium-1-yl)methyl]-2-methoxyphenoxy]-3-piperidin-1-ium-1-ylpropan-2-ol Traditional Name: (2R)-1-[5-[(4-cyclopentylpiperazin-4-ium-1-yl)methyl]-2-methoxy-phenoxy]-3-piperidin-1-ium-1-yl-propan-2-ol Formula: C25H43N3O3+2 MolecularWeight: 433.62722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CC[NH+](CC2)C3CCCC3)OCC(C[NH+]4CCCCC4)O

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CC[NH+](CC2)C3CCCC3)OC[C@@H](C[NH+]4CCCCC4)O

InChI

InChI=1S/C25H41N3O3/c1-30-24-10-9-21(18-27-13-15-28(16-14-27)22-7-3-4-8-22)17-25(24)31-20-23(29)19-26-11-5-2-6-12-26/h9-10,17,22-23,29H,2-8,11-16,18-20H2,1H3/p+2/t23-/m1/s1