2-(1-nitro-4-phenyl-cyclohexa-2,5-dien-1-yl)oxyethanoic acid

Systemtic Name: 2-(1-nitro-4-phenyl-cyclohexa-2,5-dien-1-yl)oxyethanoic acid Openeye Name: 2-(1-nitro-4-phenyl-cyclohexa-2,5-dien-1-yl)oxyacetic acid CAS Name: 2-[(1-nitro-4-phenyl-1-cyclohexa-2,5-dienyl)oxy]acetic acid IUPAC Name: 2-(1-nitro-4-phenylcyclohexa-2,5-dien-1-yl)oxyacetic acid Traditional Name: 2-(1-nitro-4-phenyl-cyclohexa-2,5-dien-1-yl)oxyacetic acid Formula: C14H13NO5 MolecularWeight: 275.25672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C=CC(C=C2)([N+](=O)[O-])OCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2C=CC(C=C2)([N+](=O)[O-])OCC(=O)O

InChI

InChI=1S/C14H13NO5/c16-13(17)10-20-14(15(18)19)8-6-12(7-9-14)11-4-2-1-3-5-11/h1-9,12H,10H2,(H,16,17)