[(4Z)-7,8-bis(oxidanyl)-6-oxidanylidene-cyclodec-4-en-1-yl] 2-nitrobenzoate

Systemtic Name: [(4Z)-7,8-bis(oxidanyl)-6-oxidanylidene-cyclodec-4-en-1-yl] 2-nitrobenzoate Openeye Name: [(4Z)-7,8-dihydroxy-6-oxo-cyclodec-4-en-1-yl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [(4Z)-7,8-dihydroxy-6-oxo-1-cyclodec-4-enyl] ester IUPAC Name: [(4Z)-7,8-dihydroxy-6-oxocyclodec-4-en-1-yl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [(4Z)-7,8-dihydroxy-6-keto-cyclodec-4-en-1-yl] ester Formula: C17H19NO7 MolecularWeight: 349.33526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC(C(C(=O)C=C1)O)O)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C/1CC(CCC(C(C(=O)/C=C1)O)O)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H19NO7/c19-14-8-4-1-5-11(9-10-15(20)16(14)21)25-17(22)12-6-2-3-7-13(12)18(23)24/h2-4,6-8,11,15-16,20-21H,1,5,9-10H2/b8-4-