2-(2,4-dinitronaphthalen-1-yl)ethanoic acid

Systemtic Name: 2-(2,4-dinitronaphthalen-1-yl)ethanoic acid Openeye Name: 2-(2,4-dinitro-1-naphthyl)acetic acid CAS Name: 2-(2,4-dinitro-1-naphthalenyl)acetic acid IUPAC Name: 2-(2,4-dinitronaphthalen-1-yl)acetic acid Traditional Name: 2-(2,4-dinitro-1-naphthyl)acetic acid Formula: C12H8N2O6 MolecularWeight: 276.20172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C2CC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2CC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H8N2O6/c15-12(16)5-9-7-3-1-2-4-8(7)10(13(17)18)6-11(9)14(19)20/h1-4,6H,5H2,(H,15,16)