2-indol-1-ylethyl-[[3-methoxy-2-[(2R)-3-morpholin-4-ium-4-yl-2-oxidanyl-propoxy]phenyl]methyl]azanium

Systemtic Name: 2-indol-1-ylethyl-[[3-methoxy-2-[(2R)-3-morpholin-4-ium-4-yl-2-oxidanyl-propoxy]phenyl]methyl]azanium Openeye Name: [2-[(2R)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]-3-methoxy-phenyl]methyl-(2-indol-1-ylethyl)ammonium CAS Name: [2-[(2R)-2-hydroxy-3-(4-morpholin-4-iumyl)propoxy]-3-methoxyphenyl]methyl-[2-(1-indolyl)ethyl]ammonium IUPAC Name: [2-[(2R)-2-hydroxy-3-morpholin-4-ium-4-ylpropoxy]-3-methoxyphenyl]methyl-(2-indol-1-ylethyl)azanium Traditional Name: [2-[(2R)-2-hydroxy-3-morpholin-4-ium-4-yl-propoxy]-3-methoxy-benzyl]-(2-indol-1-ylethyl)ammonium Formula: C25H35N3O4+2 MolecularWeight: 441.5631

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC(C[NH+]2CCOCC2)O)C[NH2+]CCN3C=CC4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC(=C1OC[C@@H](C[NH+]2CCOCC2)O)C[NH2+]CCN3C=CC4=CC=CC=C43

InChI

InChI=1S/C25H33N3O4/c1-30-24-8-4-6-21(25(24)32-19-22(29)18-27-13-15-31-16-14-27)17-26-10-12-28-11-9-20-5-2-3-7-23(20)28/h2-9,11,22,26,29H,10,12-19H2,1H3/p+2/t22-/m1/s1