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

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-chloranyl-4-ethoxy-5-methoxy-benzoate Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl 3-chloro-4-ethoxy-5-methoxy-benzoate CAS Name: 3-chloro-4-ethoxy-5-methoxybenzoic acid (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl 3-chloro-4-ethoxy-5-methoxybenzoate Traditional Name: 3-chloro-4-ethoxy-5-methoxy-benzoic acid (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C21H19ClO7 MolecularWeight: 418.82436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3C)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3C)O)OC

InChI

InChI=1S/C21H19ClO7/c1-4-27-20-15(22)7-12(8-17(20)26-3)21(25)28-10-13-9-18(24)29-19-11(2)16(23)6-5-14(13)19/h5-9,23H,4,10H2,1-3H3