(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 3-chloro-5-ethoxy-4-hydroxy-benzoate CAS Name: 3-chloro-5-ethoxy-4-hydroxybenzoic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 3-chloro-5-ethoxy-4-hydroxybenzoate Traditional Name: 3-chloro-5-ethoxy-4-hydroxy-benzoic acid (2-keto-7,8-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=C2C=CC(=C3C)C)Cl)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3C)C)Cl)O

InChI

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