4-(2-methylbut-3-en-2-yl)-1,3,5-tris(oxidanyl)xanthen-9-one

Systemtic Name: 4-(2-methylbut-3-en-2-yl)-1,3,5-tris(oxidanyl)xanthen-9-one Openeye Name: 4-(1,1-dimethylallyl)-1,3,5-trihydroxy-xanthen-9-one CAS Name: 1,3,5-trihydroxy-4-(2-methylbut-3-en-2-yl)-9-xanthenone IUPAC Name: 1,3,5-trihydroxy-4-(2-methylbut-3-en-2-yl)xanthen-9-one Traditional Name: 4-(1,1-dimethylallyl)-1,3,5-trihydroxy-xanthone Formula: C18H16O5 MolecularWeight: 312.31664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=C)C1=C(C=C(C2=C1OC3=C(C2=O)C=CC=C3O)O)O

Isomeric SMILES

CC(C)(C=C)C1=C(C=C(C2=C1OC3=C(C2=O)C=CC=C3O)O)O

InChI

InChI=1S/C18H16O5/c1-4-18(2,3)14-12(21)8-11(20)13-15(22)9-6-5-7-10(19)16(9)23-17(13)14/h4-8,19-21H,1H2,2-3H3