3-methyl-6-nitro-4-oxidanylidene-2-phenyl-chromene-8-carboxylic acid

Systemtic Name: 3-methyl-6-nitro-4-oxidanylidene-2-phenyl-chromene-8-carboxylic acid Openeye Name: 3-methyl-6-nitro-4-oxo-2-phenyl-chromene-8-carboxylic acid CAS Name: 3-methyl-6-nitro-4-oxo-2-phenyl-1-benzopyran-8-carboxylic acid IUPAC Name: 3-methyl-6-nitro-4-oxo-2-phenylchromene-8-carboxylic acid Traditional Name: 4-keto-3-methyl-6-nitro-2-phenyl-chromene-8-carboxylic acid Formula: C17H11NO6 MolecularWeight: 325.27234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C=C(C=C2C1=O)[N+](=O)[O-])C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(OC2=C(C=C(C=C2C1=O)[N+](=O)[O-])C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C17H11NO6/c1-9-14(19)12-7-11(18(22)23)8-13(17(20)21)16(12)24-15(9)10-5-3-2-4-6-10/h2-8H,1H3,(H,20,21)