6-nitro-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid

Systemtic Name: 6-nitro-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: 6-nitro-2-(trifluoromethyl)chromane-3-carboxylic acid CAS Name: 6-nitro-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-nitro-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: 6-nitro-2-(trifluoromethyl)chroman-3-carboxylic acid Formula: C11H8F3NO5 MolecularWeight: 291.18013

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=C1C=C(C=C2)[N+](=O)[O-])C(F)(F)F)C(=O)O

Isomeric SMILES

C1C(C(OC2=C1C=C(C=C2)[N+](=O)[O-])C(F)(F)F)C(=O)O

InChI

InChI=1S/C11H8F3NO5/c12-11(13,14)9-7(10(16)17)4-5-3-6(15(18)19)1-2-8(5)20-9/h1-3,7,9H,4H2,(H,16,17)