4-ethyl-7-[2,3,4-tris(oxidanyl)cyclohexyl]oxy-chromen-2-one

Systemtic Name: 4-ethyl-7-[2,3,4-tris(oxidanyl)cyclohexyl]oxy-chromen-2-one Openeye Name: 4-ethyl-7-(2,3,4-trihydroxycyclohexoxy)chromen-2-one CAS Name: 4-ethyl-7-(2,3,4-trihydroxycyclohexyl)oxy-1-benzopyran-2-one IUPAC Name: 4-ethyl-7-(2,3,4-trihydroxycyclohexyl)oxychromen-2-one Traditional Name: 4-ethyl-7-(2,3,4-trihydroxycyclohexoxy)coumarin Formula: C17H20O6 MolecularWeight: 320.3371

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2)OC3CCC(C(C3O)O)O

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2)OC3CCC(C(C3O)O)O

InChI

InChI=1S/C17H20O6/c1-2-9-7-15(19)23-14-8-10(3-4-11(9)14)22-13-6-5-12(18)16(20)17(13)21/h3-4,7-8,12-13,16-18,20-21H,2,5-6H2,1H3