5-diphenylphosphanyl-4-methoxycarbonyl-2-(3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzoic acid

Systemtic Name: 5-diphenylphosphanyl-4-methoxycarbonyl-2-(3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzoic acid Openeye Name: 5-diphenylphosphanyl-2-(3-hydroxy-6-oxo-xanthen-9-yl)-4-methoxycarbonyl-benzoic acid CAS Name: 5-diphenylphosphino-2-(3-hydroxy-6-oxo-9-xanthenyl)-4-methoxycarbonylbenzoic acid IUPAC Name: 5-diphenylphosphanyl-2-(3-hydroxy-6-oxoxanthen-9-yl)-4-methoxycarbonylbenzoic acid Traditional Name: 4-carbomethoxy-5-diphenylphosphino-2-(3-hydroxy-6-keto-xanthen-9-yl)benzoic acid Formula: C34H23O7P MolecularWeight: 574.515981

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C(=C1)C2=C3C=CC(=O)C=C3OC4=C2C=CC(=C4)O)C(=O)O)P(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

COC(=O)C1=C(C=C(C(=C1)C2=C3C=CC(=O)C=C3OC4=C2C=CC(=C4)O)C(=O)O)P(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H23O7P/c1-40-34(39)28-18-26(32-24-14-12-20(35)16-29(24)41-30-17-21(36)13-15-25(30)32)27(33(37)38)19-31(28)42(22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-19,35H,1H3,(H,37,38)