6-nitro-3-(2-oxidanylidenepentyl)chromen-2-one

Systemtic Name: 6-nitro-3-(2-oxidanylidenepentyl)chromen-2-one Openeye Name: 6-nitro-3-(2-oxopentyl)chromen-2-one CAS Name: 6-nitro-3-(2-oxopentyl)-1-benzopyran-2-one IUPAC Name: 6-nitro-3-(2-oxopentyl)chromen-2-one Traditional Name: 3-(2-ketopentyl)-6-nitro-coumarin Formula: C14H13NO5 MolecularWeight: 275.25672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)CC1=CC2=C(C=CC(=C2)[N+](=O)[O-])OC1=O

Isomeric SMILES

CCCC(=O)CC1=CC2=C(C=CC(=C2)[N+](=O)[O-])OC1=O

InChI

InChI=1S/C14H13NO5/c1-2-3-12(16)8-10-6-9-7-11(15(18)19)4-5-13(9)20-14(10)17/h4-7H,2-3,8H2,1H3