[(2R)-3-[[3-(2-azaniumylethyl)-1H-indol-5-yl]oxy]-2-oxidanyl-propyl]-propan-2-yl-azanium

Systemtic Name: [(2R)-3-[[3-(2-azaniumylethyl)-1H-indol-5-yl]oxy]-2-oxidanyl-propyl]-propan-2-yl-azanium Openeye Name: [(2R)-3-[[3-(2-azaniumylethyl)-1H-indol-5-yl]oxy]-2-hydroxy-propyl]-isopropyl-ammonium CAS Name: [(2R)-3-[[3-(2-ammonioethyl)-1H-indol-5-yl]oxy]-2-hydroxypropyl]-propan-2-ylammonium IUPAC Name: [(2R)-3-[[3-(2-azaniumylethyl)-1H-indol-5-yl]oxy]-2-hydroxypropyl]-propan-2-ylazanium Traditional Name: [(2R)-3-[[3-(2-ammonioethyl)-1H-indol-5-yl]oxy]-2-hydroxy-propyl]-isopropyl-ammonium Formula: C16H27N3O2+2 MolecularWeight: 293.40448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]CC(COC1=CC2=C(C=C1)NC=C2CC[NH3+])O

Isomeric SMILES

CC(C)[NH2+]C[C@H](COC1=CC2=C(C=C1)NC=C2CC[NH3+])O

InChI

InChI=1S/C16H25N3O2/c1-11(2)18-9-13(20)10-21-14-3-4-16-15(7-14)12(5-6-17)8-19-16/h3-4,7-8,11,13,18-20H,5-6,9-10,17H2,1-2H3/p+2/t13-/m1/s1