2-[4-[[(4-chlorophenyl)amino]methyl]phenoxy]-2-methyl-butanoic acid

Systemtic Name: 2-[4-[[(4-chlorophenyl)amino]methyl]phenoxy]-2-methyl-butanoic acid Openeye Name: 2-[4-[(4-chloroanilino)methyl]phenoxy]-2-methyl-butanoic acid CAS Name: 2-[4-[(4-chloroanilino)methyl]phenoxy]-2-methylbutanoic acid IUPAC Name: 2-[4-[(4-chloroanilino)methyl]phenoxy]-2-methylbutanoic acid Traditional Name: 2-[4-[(4-chloroanilino)methyl]phenoxy]-2-methyl-butyric acid Formula: C18H20ClNO3 MolecularWeight: 333.8093

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)O)OC1=CC=C(C=C1)CNC2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(C)(C(=O)O)OC1=CC=C(C=C1)CNC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H20ClNO3/c1-3-18(2,17(21)22)23-16-10-4-13(5-11-16)12-20-15-8-6-14(19)7-9-15/h4-11,20H,3,12H2,1-2H3,(H,21,22)