methyl 4-nitro-5-phenyl-pentanoate

Systemtic Name: methyl 4-nitro-5-phenyl-pentanoate Openeye Name: methyl 4-nitro-5-phenyl-pentanoate CAS Name: 4-nitro-5-phenylpentanoic acid methyl ester IUPAC Name: methyl 4-nitro-5-phenylpentanoate Traditional Name: 4-nitro-5-phenyl-valeric acid methyl ester Formula: C12H15NO4 MolecularWeight: 237.2518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(CC1=CC=CC=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCC(CC1=CC=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H15NO4/c1-17-12(14)8-7-11(13(15)16)9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3