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

Systemtic Name: 3-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]methylamino]-4-methyl-benzoic acid Openeye Name: 3-[(3,5-dichloro-2-hydroxy-phenyl)methylamino]-4-methyl-benzoic acid CAS Name: 3-[(3,5-dichloro-2-hydroxyphenyl)methylamino]-4-methylbenzoic acid IUPAC Name: 3-[(3,5-dichloro-2-hydroxyphenyl)methylamino]-4-methylbenzoic acid Traditional Name: 3-[(3,5-dichloro-2-hydroxy-benzyl)amino]-4-methyl-benzoic acid Formula: C15H13Cl2NO3 MolecularWeight: 326.17462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NCC2=CC(=CC(=C2O)Cl)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NCC2=CC(=CC(=C2O)Cl)Cl

InChI

InChI=1S/C15H13Cl2NO3/c1-8-2-3-9(15(20)21)5-13(8)18-7-10-4-11(16)6-12(17)14(10)19/h2-6,18-19H,7H2,1H3,(H,20,21)