2,2,4,4-tetramethyl-8-nitro-3H-chromene-6-carboxylic acid

Systemtic Name: 2,2,4,4-tetramethyl-8-nitro-3H-chromene-6-carboxylic acid Openeye Name: 2,2,4,4-tetramethyl-8-nitro-chromane-6-carboxylic acid CAS Name: 2,2,4,4-tetramethyl-8-nitro-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid IUPAC Name: 2,2,4,4-tetramethyl-8-nitro-3H-chromene-6-carboxylic acid Traditional Name: 2,2,4,4-tetramethyl-8-nitro-chroman-6-carboxylic acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(OC2=C1C=C(C=C2[N+](=O)[O-])C(=O)O)(C)C)C

Isomeric SMILES

CC1(CC(OC2=C1C=C(C=C2[N+](=O)[O-])C(=O)O)(C)C)C

InChI

InChI=1S/C14H17NO5/c1-13(2)7-14(3,4)20-11-9(13)5-8(12(16)17)6-10(11)15(18)19/h5-6H,7H2,1-4H3,(H,16,17)