2-(2,7-diethyl-3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzoic acid

Systemtic Name: 2-(2,7-diethyl-3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzoic acid Openeye Name: 2-(2,7-diethyl-3-hydroxy-6-oxo-xanthen-9-yl)benzoic acid CAS Name: 2-(2,7-diethyl-3-hydroxy-6-oxo-9-xanthenyl)benzoic acid IUPAC Name: 2-(2,7-diethyl-3-hydroxy-6-oxoxanthen-9-yl)benzoic acid Traditional Name: 2-(2,7-diethyl-3-hydroxy-6-keto-xanthen-9-yl)benzoic acid Formula: C24H20O5 MolecularWeight: 388.4126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C3=CC(=C(C=C3OC2=CC1=O)O)CC)C4=CC=CC=C4C(=O)O

Isomeric SMILES

CCC1=CC2=C(C3=CC(=C(C=C3OC2=CC1=O)O)CC)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C24H20O5/c1-3-13-9-17-21(11-19(13)25)29-22-12-20(26)14(4-2)10-18(22)23(17)15-7-5-6-8-16(15)24(27)28/h5-12,25H,3-4H2,1-2H3,(H,27,28)