1-(1-ethylindol-2-yl)ethylsulfanyl hydrogen sulfate

Systemtic Name: 1-(1-ethylindol-2-yl)ethylsulfanyl hydrogen sulfate Openeye Name: 1-(1-ethylindol-2-yl)ethylsulfanyl hydrogen sulfate CAS Name: 1-(1-ethyl-2-indolyl)ethanesulfenic acid sulfo ester IUPAC Name: 1-(1-ethylindol-2-yl)ethylsulfanyl hydrogen sulfate Traditional Name: sulfuric acid [1-(1-ethylindol-2-yl)ethylthio] ester Formula: C12H15NO4S2 MolecularWeight: 301.3818

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C=C1C(C)SOS(=O)(=O)O

Isomeric SMILES

CCN1C2=CC=CC=C2C=C1C(C)SOS(=O)(=O)O

InChI

InChI=1S/C12H15NO4S2/c1-3-13-11-7-5-4-6-10(11)8-12(13)9(2)18-17-19(14,15)16/h4-9H,3H2,1-2H3,(H,14,15,16)