2-[2-chloranyl-6-(dimethylamino)-9H-xanthen-9-yl]benzoic acid

Systemtic Name: 2-[2-chloranyl-6-(dimethylamino)-9H-xanthen-9-yl]benzoic acid Openeye Name: 2-[2-chloro-6-(dimethylamino)-9H-xanthen-9-yl]benzoic acid CAS Name: 2-[2-chloro-6-(dimethylamino)-9H-xanthen-9-yl]benzoic acid IUPAC Name: 2-[2-chloro-6-(dimethylamino)-9H-xanthen-9-yl]benzoic acid Traditional Name: 2-[2-chloro-6-(dimethylamino)-9H-xanthen-9-yl]benzoic acid Formula: C22H18ClNO3 MolecularWeight: 379.83622

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)C(C3=C(O2)C=CC(=C3)Cl)C4=CC=CC=C4C(=O)O

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)C(C3=C(O2)C=CC(=C3)Cl)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C22H18ClNO3/c1-24(2)14-8-9-17-20(12-14)27-19-10-7-13(23)11-18(19)21(17)15-5-3-4-6-16(15)22(25)26/h3-12,21H,1-2H3,(H,25,26)