5-nitro-1-[2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]pyridin-2-one

Systemtic Name: 5-nitro-1-[2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]pyridin-2-one Openeye Name: 5-nitro-1-[2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]pyridin-2-one CAS Name: 5-nitro-1-[2-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-2-pyridinone IUPAC Name: 5-nitro-1-[2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]pyridin-2-one Traditional Name: 1-[2-keto-2-[4-(3-nitrophenyl)sulfonylpiperazino]ethyl]-5-nitro-2-pyridone Formula: C17H17N5O8S MolecularWeight: 451.41058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=C(C=CC2=O)[N+](=O)[O-])S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=C(C=CC2=O)[N+](=O)[O-])S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O8S/c23-16-5-4-14(22(27)28)11-19(16)12-17(24)18-6-8-20(9-7-18)31(29,30)15-3-1-2-13(10-15)21(25)26/h1-5,10-11H,6-9,12H2