2-[3,6-bis(oxidanyl)-4aH-xanthen-9-yl]benzoic acid

Systemtic Name: 2-[3,6-bis(oxidanyl)-4aH-xanthen-9-yl]benzoic acid Openeye Name: 2-(3,6-dihydroxy-4aH-xanthen-9-yl)benzoic acid CAS Name: 2-(3,6-dihydroxy-4aH-xanthen-9-yl)benzoic acid IUPAC Name: 2-(3,6-dihydroxy-4aH-xanthen-9-yl)benzoic acid Traditional Name: 2-(3,6-dihydroxy-4aH-xanthen-9-yl)benzoic acid Formula: C20H14O5 MolecularWeight: 334.32216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C3C=CC(=CC3OC4=C2C=CC(=C4)O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=C3C=CC(=CC3OC4=C2C=CC(=C4)O)O)C(=O)O

InChI

InChI=1S/C20H14O5/c21-11-5-7-15-17(9-11)25-18-10-12(22)6-8-16(18)19(15)13-3-1-2-4-14(13)20(23)24/h1-10,17,21-22H,(H,23,24)