(3,3-dimethyl-2-oxidanylidene-butyl) 3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate CAS Name: 3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 3-methyl-4-oxo-2-phenylchromene-8-carboxylate Traditional Name: 4-keto-3-methyl-2-phenyl-chromene-8-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C23H22O5 MolecularWeight: 378.41778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCC(=O)C(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCC(=O)C(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C23H22O5/c1-14-19(25)16-11-8-12-17(22(26)27-13-18(24)23(2,3)4)21(16)28-20(14)15-9-6-5-7-10-15/h5-12H,13H2,1-4H3