5-chloranyl-4-(2,2-dimethylpropylamino)-2-methoxy-benzoic acid

Systemtic Name: 5-chloranyl-4-(2,2-dimethylpropylamino)-2-methoxy-benzoic acid Openeye Name: 5-chloro-4-(2,2-dimethylpropylamino)-2-methoxy-benzoic acid CAS Name: 5-chloro-4-(2,2-dimethylpropylamino)-2-methoxybenzoic acid IUPAC Name: 5-chloro-4-(2,2-dimethylpropylamino)-2-methoxybenzoic acid Traditional Name: 5-chloro-2-methoxy-4-(neopentylamino)benzoic acid Formula: C13H18ClNO3 MolecularWeight: 271.73992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC1=C(C=C(C(=C1)OC)C(=O)O)Cl

Isomeric SMILES

CC(C)(C)CNC1=C(C=C(C(=C1)OC)C(=O)O)Cl

InChI

InChI=1S/C13H18ClNO3/c1-13(2,3)7-15-10-6-11(18-4)8(12(16)17)5-9(10)14/h5-6,15H,7H2,1-4H3,(H,16,17)