2-methyl-6-nitro-2-(trifluoromethyl)chromene-4-carboxylic acid

Systemtic Name: 2-methyl-6-nitro-2-(trifluoromethyl)chromene-4-carboxylic acid Openeye Name: 2-methyl-6-nitro-2-(trifluoromethyl)chromene-4-carboxylic acid CAS Name: 2-methyl-6-nitro-2-(trifluoromethyl)-1-benzopyran-4-carboxylic acid IUPAC Name: 2-methyl-6-nitro-2-(trifluoromethyl)chromene-4-carboxylic acid Traditional Name: 2-methyl-6-nitro-2-(trifluoromethyl)chromene-4-carboxylic acid Formula: C12H8F3NO5 MolecularWeight: 303.19083

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])C(=O)O)C(F)(F)F

Isomeric SMILES

CC1(C=C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])C(=O)O)C(F)(F)F

InChI

InChI=1S/C12H8F3NO5/c1-11(12(13,14)15)5-8(10(17)18)7-4-6(16(19)20)2-3-9(7)21-11/h2-5H,1H3,(H,17,18)