1-(2-nitrophenyl)-2,7-bis(oxidanyl)heptan-1-one

Systemtic Name: 1-(2-nitrophenyl)-2,7-bis(oxidanyl)heptan-1-one Openeye Name: 2,7-dihydroxy-1-(2-nitrophenyl)heptan-1-one CAS Name: 2,7-dihydroxy-1-(2-nitrophenyl)-1-heptanone IUPAC Name: 2,7-dihydroxy-1-(2-nitrophenyl)heptan-1-one Traditional Name: 2,7-dihydroxy-1-(2-nitrophenyl)heptan-1-one Formula: C13H17NO5 MolecularWeight: 267.27778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO5/c15-9-5-1-2-8-12(16)13(17)10-6-3-4-7-11(10)14(18)19/h3-4,6-7,12,15-16H,1-2,5,8-9H2