methyl 5-chloranyl-6-methyl-8-oxidanyl-9-oxidanylidene-xanthene-1-carboxylate

Systemtic Name: methyl 5-chloranyl-6-methyl-8-oxidanyl-9-oxidanylidene-xanthene-1-carboxylate Openeye Name: methyl 5-chloro-8-hydroxy-6-methyl-9-oxo-xanthene-1-carboxylate CAS Name: 5-chloro-8-hydroxy-6-methyl-9-oxo-1-xanthenecarboxylic acid methyl ester IUPAC Name: methyl 5-chloro-8-hydroxy-6-methyl-9-oxoxanthene-1-carboxylate Traditional Name: 5-chloro-8-hydroxy-9-keto-6-methyl-xanthene-1-carboxylic acid methyl ester Formula: C16H11ClO5 MolecularWeight: 318.70854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1Cl)OC3=CC=CC(=C3C2=O)C(=O)OC)O

Isomeric SMILES

CC1=CC(=C2C(=C1Cl)OC3=CC=CC(=C3C2=O)C(=O)OC)O

InChI

InChI=1S/C16H11ClO5/c1-7-6-9(18)12-14(19)11-8(16(20)21-2)4-3-5-10(11)22-15(12)13(7)17/h3-6,18H,1-2H3