4-methyl-5,7-bis(oxidanyl)chromen-2-one hydrate

Systemtic Name: 4-methyl-5,7-bis(oxidanyl)chromen-2-one hydrate Openeye Name: 5,7-dihydroxy-4-methyl-chromen-2-one hydrate CAS Name: 5,7-dihydroxy-4-methyl-1-benzopyran-2-one hydrate IUPAC Name: 5,7-dihydroxy-4-methylchromen-2-one hydrate Traditional Name: 5,7-dihydroxy-4-methyl-coumarin hydrate Formula: C10H10O5 MolecularWeight: 210.1834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=CC(=C12)O)O.O

Isomeric SMILES

CC1=CC(=O)OC2=CC(=CC(=C12)O)O.O

InChI

InChI=1S/C10H8O4.H2O/c1-5-2-9(13)14-8-4-6(11)3-7(12)10(5)8;/h2-4,11-12H,1H3;1H2