1-[2-methyl-5-(nitromethylsulfonyl)-2,3-dihydroindol-1-yl]ethanone

Systemtic Name: 1-[2-methyl-5-(nitromethylsulfonyl)-2,3-dihydroindol-1-yl]ethanone Openeye Name: 1-[2-methyl-5-(nitromethylsulfonyl)indolin-1-yl]ethanone CAS Name: 1-[2-methyl-5-(nitromethylsulfonyl)-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 1-[2-methyl-5-(nitromethylsulfonyl)-2,3-dihydroindol-1-yl]ethanone Traditional Name: 1-[2-methyl-5-(nitromethylsulfonyl)indolin-1-yl]ethanone Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1C(=O)C)C=CC(=C2)S(=O)(=O)C[N+](=O)[O-]

Isomeric SMILES

CC1CC2=C(N1C(=O)C)C=CC(=C2)S(=O)(=O)C[N+](=O)[O-]

InChI

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