2-ethyl-2-(4-nitrophenyl)pentanedioic acid

Systemtic Name: 2-ethyl-2-(4-nitrophenyl)pentanedioic acid Openeye Name: 2-ethyl-2-(4-nitrophenyl)pentanedioic acid CAS Name: 2-ethyl-2-(4-nitrophenyl)pentanedioic acid IUPAC Name: 2-ethyl-2-(4-nitrophenyl)pentanedioic acid Traditional Name: 2-ethyl-2-(4-nitrophenyl)glutaric acid Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO6/c1-2-13(12(17)18,8-7-11(15)16)9-3-5-10(6-4-9)14(19)20/h3-6H,2,7-8H2,1H3,(H,15,16)(H,17,18)