2-(2-methyl-1H-indol-3-yl)ethyl-[[3-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propoxy]phenyl]methyl]azanium

Systemtic Name: 2-(2-methyl-1H-indol-3-yl)ethyl-[[3-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propoxy]phenyl]methyl]azanium Openeye Name: [3-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]phenyl]methyl-[2-(2-methyl-1H-indol-3-yl)ethyl]ammonium CAS Name: [3-[(2S)-2-hydroxy-3-(4-morpholin-4-iumyl)propoxy]phenyl]methyl-[2-(2-methyl-1H-indol-3-yl)ethyl]ammonium IUPAC Name: [3-[(2S)-2-hydroxy-3-morpholin-4-ium-4-ylpropoxy]phenyl]methyl-[2-(2-methyl-1H-indol-3-yl)ethyl]azanium Traditional Name: [3-[(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]benzyl]-[2-(2-methyl-1H-indol-3-yl)ethyl]ammonium Formula: C25H35N3O3+2 MolecularWeight: 425.5637

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)CC[NH2+]CC3=CC(=CC=C3)OCC(C[NH+]4CCOCC4)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)CC[NH2+]CC3=CC(=CC=C3)OC[C@H](C[NH+]4CCOCC4)O

InChI

InChI=1S/C25H33N3O3/c1-19-23(24-7-2-3-8-25(24)27-19)9-10-26-16-20-5-4-6-22(15-20)31-18-21(29)17-28-11-13-30-14-12-28/h2-8,15,21,26-27,29H,9-14,16-18H2,1H3/p+2/t21-/m0/s1