(3,3-dimethyl-2-oxidanylidene-butyl) 6-chloranyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 6-chloranyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 6-chloro-4-oxo-chromene-2-carboxylate CAS Name: 6-chloro-4-oxo-1-benzopyran-2-carboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 6-chloro-4-oxochromene-2-carboxylate Traditional Name: 6-chloro-4-keto-chromene-2-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C16H15ClO5 MolecularWeight: 322.7403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC(=O)C2=C(O1)C=CC(=C2)Cl

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC(=O)C2=C(O1)C=CC(=C2)Cl

InChI

InChI=1S/C16H15ClO5/c1-16(2,3)14(19)8-21-15(20)13-7-11(18)10-6-9(17)4-5-12(10)22-13/h4-7H,8H2,1-3H3