[3-(2-acetamidoethyl)-5-methoxy-1H-indol-6-yl] hydrogen sulfate

Systemtic Name: [3-(2-acetamidoethyl)-5-methoxy-1H-indol-6-yl] hydrogen sulfate Openeye Name: [3-(2-acetamidoethyl)-5-methoxy-1H-indol-6-yl] hydrogen sulfate CAS Name: sulfuric acid [3-(2-acetamidoethyl)-5-methoxy-1H-indol-6-yl] ester IUPAC Name: [3-(2-acetamidoethyl)-5-methoxy-1H-indol-6-yl] hydrogen sulfate Traditional Name: sulfuric acid [3-(2-acetamidoethyl)-5-methoxy-1H-indol-6-yl] ester Formula: C13H16N2O6S MolecularWeight: 328.34094

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=CNC2=CC(=C(C=C21)OC)OS(=O)(=O)O

Isomeric SMILES

CC(=O)NCCC1=CNC2=CC(=C(C=C21)OC)OS(=O)(=O)O

InChI

InChI=1S/C13H16N2O6S/c1-8(16)14-4-3-9-7-15-11-6-13(21-22(17,18)19)12(20-2)5-10(9)11/h5-7,15H,3-4H2,1-2H3,(H,14,16)(H,17,18,19)