4-(aminocarbamoyl)-2-[2,7-bis(chloranyl)-3-oxidanyl-6-oxidanylidene-xanthen-9-yl]benzoic acid

Systemtic Name: 4-(aminocarbamoyl)-2-[2,7-bis(chloranyl)-3-oxidanyl-6-oxidanylidene-xanthen-9-yl]benzoic acid Openeye Name: 2-(2,7-dichloro-3-hydroxy-6-oxo-xanthen-9-yl)-4-(hydrazinecarbonyl)benzoic acid CAS Name: 2-(2,7-dichloro-3-hydroxy-6-oxo-9-xanthenyl)-4-(hydrazinecarbonyl)benzoic acid IUPAC Name: 2-(2,7-dichloro-3-hydroxy-6-oxoxanthen-9-yl)-4-(hydrazinecarbonyl)benzoic acid Traditional Name: 4-carbazoyl-2-(2,7-dichloro-3-hydroxy-6-keto-xanthen-9-yl)benzoic acid Formula: C21H12Cl2N2O6 MolecularWeight: 459.23578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NN)C2=C3C=C(C(=O)C=C3OC4=CC(=C(C=C42)Cl)O)Cl)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NN)C2=C3C=C(C(=O)C=C3OC4=CC(=C(C=C42)Cl)O)Cl)C(=O)O

InChI

InChI=1S/C21H12Cl2N2O6/c22-13-4-11-17(6-15(13)26)31-18-7-16(27)14(23)5-12(18)19(11)10-3-8(20(28)25-24)1-2-9(10)21(29)30/h1-7,26H,24H2,(H,25,28)(H,29,30)