(2S)-1-[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]phenoxy]-3-(4-methylpiperazine-1,4-diium-1-yl)propan-2-ol

Systemtic Name: (2S)-1-[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]phenoxy]-3-(4-methylpiperazine-1,4-diium-1-yl)propan-2-ol Openeye Name: (2S)-1-[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]phenoxy]-3-(4-methylpiperazine-1,4-diium-1-yl)propan-2-ol CAS Name: (2S)-1-[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]phenoxy]-3-(4-methyl-1-piperazine-1,4-diiumyl)-2-propanol IUPAC Name: (2S)-1-[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]phenoxy]-3-(4-methylpiperazine-1,4-diium-1-yl)propan-2-ol Traditional Name: (2S)-1-[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]phenoxy]-3-(4-methylpiperazine-1,4-diium-1-yl)propan-2-ol Formula: C18H28N4O4+2 MolecularWeight: 364.43932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)COC2=CC=CC=C2OCC(C[NH+]3CC[NH+](CC3)C)O

Isomeric SMILES

CC1=NOC(=N1)COC2=CC=CC=C2OC[C@H](C[NH+]3CC[NH+](CC3)C)O

InChI

InChI=1S/C18H26N4O4/c1-14-19-18(26-20-14)13-25-17-6-4-3-5-16(17)24-12-15(23)11-22-9-7-21(2)8-10-22/h3-6,15,23H,7-13H2,1-2H3/p+2/t15-/m0/s1