[3-[[3-(2-azanylethyl)-1H-indol-5-yl]oxy]-2-oxidanyl-propyl]-propan-2-yl-azanium; hydrogen sulfate

Systemtic Name: [3-[[3-(2-azanylethyl)-1H-indol-5-yl]oxy]-2-oxidanyl-propyl]-propan-2-yl-azanium; hydrogen sulfate Openeye Name: [3-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-2-hydroxy-propyl]-isopropyl-ammonium; hydrogen sulfate CAS Name: [3-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-2-hydroxypropyl]-propan-2-ylammonium; hydrogen sulfate IUPAC Name: [3-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-2-hydroxypropyl]-propan-2-ylazanium; hydrogen sulfate Traditional Name: [3-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-2-hydroxy-propyl]-isopropyl-ammonium bisulfate Formula: C16H27N3O6S MolecularWeight: 389.46708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]CC(COC1=CC2=C(C=C1)NC=C2CCN)O.OS(=O)(=O)[O-]

Isomeric SMILES

CC(C)[NH2+]CC(COC1=CC2=C(C=C1)NC=C2CCN)O.OS(=O)(=O)[O-]

InChI

InChI=1S/C16H25N3O2.H2O4S/c1-11(2)18-9-13(20)10-21-14-3-4-16-15(7-14)12(5-6-17)8-19-16;1-5(2,3)4/h3-4,7-8,11,13,18-20H,5-6,9-10,17H2,1-2H3;(H2,1,2,3,4)