ethyl 5-nitro-4-phenyl-pentanoate

Systemtic Name: ethyl 5-nitro-4-phenyl-pentanoate Openeye Name: ethyl 5-nitro-4-phenyl-pentanoate CAS Name: 5-nitro-4-phenylpentanoic acid ethyl ester IUPAC Name: ethyl 5-nitro-4-phenylpentanoate Traditional Name: 5-nitro-4-phenyl-valeric acid ethyl ester Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4/c1-2-18-13(15)9-8-12(10-14(16)17)11-6-4-3-5-7-11/h3-7,12H,2,8-10H2,1H3