4-[[2-(4-chloranylphenoxy)-2-methyl-propyl]amino]benzoic acid

Systemtic Name: 4-[[2-(4-chloranylphenoxy)-2-methyl-propyl]amino]benzoic acid Openeye Name: 4-[[2-(4-chlorophenoxy)-2-methyl-propyl]amino]benzoic acid CAS Name: 4-[[2-(4-chlorophenoxy)-2-methylpropyl]amino]benzoic acid IUPAC Name: 4-[[2-(4-chlorophenoxy)-2-methylpropyl]amino]benzoic acid Traditional Name: 4-[[2-(4-chlorophenoxy)-2-methyl-propyl]amino]benzoic acid Formula: C17H18ClNO3 MolecularWeight: 319.78272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=CC=C(C=C1)C(=O)O)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(CNC1=CC=C(C=C1)C(=O)O)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H18ClNO3/c1-17(2,22-15-9-5-13(18)6-10-15)11-19-14-7-3-12(4-8-14)16(20)21/h3-10,19H,11H2,1-2H3,(H,20,21)