methyl 4-nitro-3-phenyl-butanoate

Systemtic Name: methyl 4-nitro-3-phenyl-butanoate Openeye Name: methyl 4-nitro-3-phenyl-butanoate CAS Name: 4-nitro-3-phenylbutanoic acid methyl ester IUPAC Name: methyl 4-nitro-3-phenylbutanoate Traditional Name: 4-nitro-3-phenyl-butyric acid methyl ester Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO4/c1-16-11(13)7-10(8-12(14)15)9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3