N-methyl-1,3-bis(oxidanylidene)-N-pyridin-4-ylsulfonyl-propan-1-amine oxide

Systemtic Name: N-methyl-1,3-bis(oxidanylidene)-N-pyridin-4-ylsulfonyl-propan-1-amine oxide Openeye Name: N-methyl-1,3-dioxo-N-(4-pyridylsulfonyl)propan-1-amine oxide CAS Name: N-methyl-1,3-dioxo-N-pyridin-4-ylsulfonyl-1-propanamine oxide IUPAC Name: N-methyl-1,3-dioxo-N-pyridin-4-ylsulfonylpropan-1-amine oxide Traditional Name: 1,3-diketo-N-methyl-N-(4-pyridylsulfonyl)propan-1-amine oxide Formula: C9H10N2O5S MolecularWeight: 258.2511

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C(=O)CC=O)([O-])S(=O)(=O)C1=CC=NC=C1

Isomeric SMILES

C[N+](C(=O)CC=O)([O-])S(=O)(=O)C1=CC=NC=C1

InChI

InChI=1S/C9H10N2O5S/c1-11(14,9(13)4-7-12)17(15,16)8-2-5-10-6-3-8/h2-3,5-7H,4H2,1H3