2-(4-nitrophenyl)carbonylpentanoic acid

Systemtic Name: 2-(4-nitrophenyl)carbonylpentanoic acid Openeye Name: 2-(4-nitrobenzoyl)pentanoic acid CAS Name: 2-[(4-nitrophenyl)-oxomethyl]pentanoic acid IUPAC Name: 2-(4-nitrobenzoyl)pentanoic acid Traditional Name: 2-(4-nitrobenzoyl)valeric acid Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO5/c1-2-3-10(12(15)16)11(14)8-4-6-9(7-5-8)13(17)18/h4-7,10H,2-3H2,1H3,(H,15,16)