tert-butyl-[(2R)-3-[[3-(2-methoxy-2-oxidanylidene-ethyl)-1H-indol-5-yl]oxy]-2-oxidanyl-propyl]azanium

Systemtic Name: tert-butyl-[(2R)-3-[[3-(2-methoxy-2-oxidanylidene-ethyl)-1H-indol-5-yl]oxy]-2-oxidanyl-propyl]azanium Openeye Name: tert-butyl-[(2R)-2-hydroxy-3-[[3-(2-methoxy-2-oxo-ethyl)-1H-indol-5-yl]oxy]propyl]ammonium CAS Name: tert-butyl-[(2R)-2-hydroxy-3-[[3-(2-methoxy-2-oxoethyl)-1H-indol-5-yl]oxy]propyl]ammonium IUPAC Name: tert-butyl-[(2R)-2-hydroxy-3-[[3-(2-methoxy-2-oxoethyl)-1H-indol-5-yl]oxy]propyl]azanium Traditional Name: tert-butyl-[(2R)-2-hydroxy-3-[[3-(2-keto-2-methoxy-ethyl)-1H-indol-5-yl]oxy]propyl]ammonium Formula: C18H27N2O4+ MolecularWeight: 335.41798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC(COC1=CC2=C(C=C1)NC=C2CC(=O)OC)O

Isomeric SMILES

CC(C)(C)[NH2+]C[C@H](COC1=CC2=C(C=C1)NC=C2CC(=O)OC)O

InChI

InChI=1S/C18H26N2O4/c1-18(2,3)20-10-13(21)11-24-14-5-6-16-15(8-14)12(9-19-16)7-17(22)23-4/h5-6,8-9,13,19-21H,7,10-11H2,1-4H3/p+1/t13-/m1/s1