[4-[(2R)-3-(4-methylpiperazin-4-ium-1-yl)-2-oxidanyl-propoxy]phenyl]methyl-(1-propylpiperidin-4-yl)azanium

Systemtic Name: [4-[(2R)-3-(4-methylpiperazin-4-ium-1-yl)-2-oxidanyl-propoxy]phenyl]methyl-(1-propylpiperidin-4-yl)azanium Openeye Name: [4-[(2R)-2-hydroxy-3-(4-methylpiperazin-4-ium-1-yl)propoxy]phenyl]methyl-(1-propyl-4-piperidyl)ammonium CAS Name: [4-[(2R)-2-hydroxy-3-(4-methyl-1-piperazin-4-iumyl)propoxy]phenyl]methyl-(1-propyl-4-piperidinyl)ammonium IUPAC Name: [4-[(2R)-2-hydroxy-3-(4-methylpiperazin-4-ium-1-yl)propoxy]phenyl]methyl-(1-propylpiperidin-4-yl)azanium Traditional Name: [4-[(2R)-2-hydroxy-3-(4-methylpiperazin-4-ium-1-yl)propoxy]benzyl]-(1-propyl-4-piperidyl)ammonium Formula: C23H42N4O2+2 MolecularWeight: 406.60518

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)[NH2+]CC2=CC=C(C=C2)OCC(CN3CC[NH+](CC3)C)O

Isomeric SMILES

CCCN1CCC(CC1)[NH2+]CC2=CC=C(C=C2)OC[C@@H](CN3CC[NH+](CC3)C)O

InChI

InChI=1S/C23H40N4O2/c1-3-10-26-11-8-21(9-12-26)24-17-20-4-6-23(7-5-20)29-19-22(28)18-27-15-13-25(2)14-16-27/h4-7,21-22,24,28H,3,8-19H2,1-2H3/p+2/t22-/m1/s1