2-(1-methyl-5-nitro-indol-4-yl)ethyl methanesulfonate

Systemtic Name: 2-(1-methyl-5-nitro-indol-4-yl)ethyl methanesulfonate Openeye Name: 2-(1-methyl-5-nitro-indol-4-yl)ethyl methanesulfonate CAS Name: methanesulfonic acid 2-(1-methyl-5-nitro-4-indolyl)ethyl ester IUPAC Name: 2-(1-methyl-5-nitroindol-4-yl)ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-(1-methyl-5-nitro-indol-4-yl)ethyl ester Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2CCOS(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2CCOS(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O5S/c1-13-7-5-9-10(6-8-19-20(2,17)18)12(14(15)16)4-3-11(9)13/h3-5,7H,6,8H2,1-2H3