methyl 4-nitro-3-phenyl-pentanoate

Systemtic Name: methyl 4-nitro-3-phenyl-pentanoate Openeye Name: methyl 4-nitro-3-phenyl-pentanoate CAS Name: 4-nitro-3-phenylpentanoic acid methyl ester IUPAC Name: methyl 4-nitro-3-phenylpentanoate Traditional Name: 4-nitro-3-phenyl-valeric acid methyl ester Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO4/c1-9(13(15)16)11(8-12(14)17-2)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3