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

Systemtic Name: 4-[(5-chloranyl-2-oxidanyl-phenyl)methylamino]-3-methyl-benzoic acid Openeye Name: 4-[(5-chloro-2-hydroxy-phenyl)methylamino]-3-methyl-benzoic acid CAS Name: 4-[(5-chloro-2-hydroxyphenyl)methylamino]-3-methylbenzoic acid IUPAC Name: 4-[(5-chloro-2-hydroxyphenyl)methylamino]-3-methylbenzoic acid Traditional Name: 4-[(5-chloro-2-hydroxy-benzyl)amino]-3-methyl-benzoic acid Formula: C15H14ClNO3 MolecularWeight: 291.72956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NCC2=C(C=CC(=C2)Cl)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NCC2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C15H14ClNO3/c1-9-6-10(15(19)20)2-4-13(9)17-8-11-7-12(16)3-5-14(11)18/h2-7,17-18H,8H2,1H3,(H,19,20)