[4-methyl-1-(4-nitrophenyl)-3-oxidanylidene-pentyl] ethanoate

Systemtic Name: [4-methyl-1-(4-nitrophenyl)-3-oxidanylidene-pentyl] ethanoate Openeye Name: [4-methyl-1-(4-nitrophenyl)-3-oxo-pentyl] acetate CAS Name: acetic acid [4-methyl-1-(4-nitrophenyl)-3-oxopentyl] ester IUPAC Name: [4-methyl-1-(4-nitrophenyl)-3-oxopentyl] acetate Traditional Name: acetic acid [3-keto-4-methyl-1-(4-nitrophenyl)pentyl] ester Formula: C14H17NO5 MolecularWeight: 279.28848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO5/c1-9(2)13(17)8-14(20-10(3)16)11-4-6-12(7-5-11)15(18)19/h4-7,9,14H,8H2,1-3H3