2-[9-[(2-chlorophenyl)amino]xanthen-9-yl]benzoic acid

Systemtic Name: 2-[9-[(2-chlorophenyl)amino]xanthen-9-yl]benzoic acid Openeye Name: 2-[9-(2-chloroanilino)xanthen-9-yl]benzoic acid CAS Name: 2-[9-(2-chloroanilino)-9-xanthenyl]benzoic acid IUPAC Name: 2-[9-(2-chloroanilino)xanthen-9-yl]benzoic acid Traditional Name: 2-[9-(2-chloroanilino)xanthen-9-yl]benzoic acid Formula: C26H18ClNO3 MolecularWeight: 427.87902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)C2(C3=CC=CC=C3OC4=CC=CC=C42)NC5=CC=CC=C5Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)C2(C3=CC=CC=C3OC4=CC=CC=C42)NC5=CC=CC=C5Cl

InChI

InChI=1S/C26H18ClNO3/c27-21-13-5-6-14-22(21)28-26(18-10-2-1-9-17(18)25(29)30)19-11-3-7-15-23(19)31-24-16-8-4-12-20(24)26/h1-16,28H,(H,29,30)