1-[7-(nitromethylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone

Systemtic Name: 1-[7-(nitromethylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone Openeye Name: 1-[7-(nitromethylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone CAS Name: 1-[7-(nitromethylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone IUPAC Name: 1-[7-(nitromethylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone Traditional Name: 1-[7-(nitromethylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone Formula: C12H14N2O5S MolecularWeight: 298.31496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC2=C1C=C(C=C2)S(=O)(=O)C[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCCC2=C1C=C(C=C2)S(=O)(=O)C[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O5S/c1-9(15)13-6-2-3-10-4-5-11(7-12(10)13)20(18,19)8-14(16)17/h4-5,7H,2-3,6,8H2,1H3