3-[2-fluoranyl-7-(10-methylanthracen-9-yl)-3-oxidanyl-6-oxidanylidene-xanthen-9-yl]phthalic acid

Systemtic Name: 3-[2-fluoranyl-7-(10-methylanthracen-9-yl)-3-oxidanyl-6-oxidanylidene-xanthen-9-yl]phthalic acid Openeye Name: 3-[2-fluoro-3-hydroxy-7-(10-methyl-9-anthryl)-6-oxo-xanthen-9-yl]phthalic acid CAS Name: 3-[2-fluoro-3-hydroxy-7-(10-methyl-9-anthracenyl)-6-oxo-9-xanthenyl]phthalic acid IUPAC Name: 3-[2-fluoro-3-hydroxy-7-(10-methylanthracen-9-yl)-6-oxoxanthen-9-yl]phthalic acid Traditional Name: 3-[2-fluoro-3-hydroxy-6-keto-7-(10-methyl-9-anthryl)xanthen-9-yl]phthalic acid Formula: C36H21FO7 MolecularWeight: 584.546143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=CC2=C(C3=CC=CC=C13)C4=CC5=C(C6=CC(=C(C=C6OC5=CC4=O)O)F)C7=C(C(=CC=C7)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C2C=CC=CC2=C(C3=CC=CC=C13)C4=CC5=C(C6=CC(=C(C=C6OC5=CC4=O)O)F)C7=C(C(=CC=C7)C(=O)O)C(=O)O

InChI

InChI=1S/C36H21FO7/c1-17-18-7-2-4-9-20(18)32(21-10-5-3-8-19(17)21)24-13-25-30(15-28(24)38)44-31-16-29(39)27(37)14-26(31)33(25)22-11-6-12-23(35(40)41)34(22)36(42)43/h2-16,39H,1H3,(H,40,41)(H,42,43)