3-[4-[(5-nitropyridin-2-yl)hydrazinylidene]-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]propyl-propyl-sulfamic acid

Systemtic Name: 3-[4-[(5-nitropyridin-2-yl)hydrazinylidene]-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]propyl-propyl-sulfamic acid Openeye Name: 3-[4-[(5-nitro-2-pyridyl)hydrazono]-3-oxo-cyclohexa-1,5-dien-1-yl]propyl-propyl-sulfamic acid CAS Name: 3-[4-[(5-nitro-2-pyridinyl)hydrazinylidene]-3-oxo-1-cyclohexa-1,5-dienyl]propyl-propylsulfamic acid IUPAC Name: 3-[4-[(5-nitropyridin-2-yl)hydrazinylidene]-3-oxocyclohexa-1,5-dien-1-yl]propyl-propylsulfamic acid Traditional Name: 3-[3-keto-4-[(5-nitro-2-pyridyl)hydrazono]cyclohexa-1,5-dien-1-yl]propyl-propyl-sulfamic acid Formula: C17H21N5O6S MolecularWeight: 423.44354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCC1=CC(=O)C(=NNC2=NC=C(C=C2)[N+](=O)[O-])C=C1)S(=O)(=O)O

Isomeric SMILES

CCCN(CCCC1=CC(=O)C(=NNC2=NC=C(C=C2)[N+](=O)[O-])C=C1)S(=O)(=O)O

InChI

InChI=1S/C17H21N5O6S/c1-2-9-21(29(26,27)28)10-3-4-13-5-7-15(16(23)11-13)19-20-17-8-6-14(12-18-17)22(24)25/h5-8,11-12H,2-4,9-10H2,1H3,(H,18,20)(H,26,27,28)