4-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]methylamino]benzoic acid

Systemtic Name: 4-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]methylamino]benzoic acid Openeye Name: 4-[(3,5-dichloro-2-hydroxy-phenyl)methylamino]benzoic acid CAS Name: 4-[(3,5-dichloro-2-hydroxyphenyl)methylamino]benzoic acid IUPAC Name: 4-[(3,5-dichloro-2-hydroxyphenyl)methylamino]benzoic acid Traditional Name: 4-[(3,5-dichloro-2-hydroxy-benzyl)amino]benzoic acid Formula: C14H11Cl2NO3 MolecularWeight: 312.14804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NCC2=CC(=CC(=C2O)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NCC2=CC(=CC(=C2O)Cl)Cl

InChI

InChI=1S/C14H11Cl2NO3/c15-10-5-9(13(18)12(16)6-10)7-17-11-3-1-8(2-4-11)14(19)20/h1-6,17-18H,7H2,(H,19,20)