(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 3-chloro-5-ethoxy-4-hydroxy-benzoate CAS Name: 3-chloro-5-ethoxy-4-hydroxybenzoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 3-chloro-5-ethoxy-4-hydroxybenzoate Traditional Name: 3-chloro-5-ethoxy-4-hydroxy-benzoic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C21H19ClO6 MolecularWeight: 402.82496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)C)C)Cl)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)C)C)Cl)O

InChI

InChI=1S/C21H19ClO6/c1-4-26-18-8-13(7-16(22)20(18)24)21(25)27-10-14-9-19(23)28-17-6-12(3)11(2)5-15(14)17/h5-9,24H,4,10H2,1-3H3