2-(2,5,6-trimethyl-9-oxidanylidene-xanthen-4-yl)ethanoic acid

Systemtic Name: 2-(2,5,6-trimethyl-9-oxidanylidene-xanthen-4-yl)ethanoic acid Openeye Name: 2-(2,5,6-trimethyl-9-oxo-xanthen-4-yl)acetic acid CAS Name: 2-(2,5,6-trimethyl-9-oxo-4-xanthenyl)acetic acid IUPAC Name: 2-(2,5,6-trimethyl-9-oxoxanthen-4-yl)acetic acid Traditional Name: 2-(9-keto-2,5,6-trimethyl-xanthen-4-yl)acetic acid Formula: C18H16O4 MolecularWeight: 296.31724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)C3=CC(=CC(=C3O2)CC(=O)O)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)C3=CC(=CC(=C3O2)CC(=O)O)C)C

InChI

InChI=1S/C18H16O4/c1-9-6-12(8-15(19)20)18-14(7-9)16(21)13-5-4-10(2)11(3)17(13)22-18/h4-7H,8H2,1-3H3,(H,19,20)