4-azanyl-2-(2,3-dimethylpentan-2-yl)benzoic acid

Systemtic Name: 4-azanyl-2-(2,3-dimethylpentan-2-yl)benzoic acid Openeye Name: 4-amino-2-(1,1,2-trimethylbutyl)benzoic acid CAS Name: 4-amino-2-(2,3-dimethylpentan-2-yl)benzoic acid IUPAC Name: 4-amino-2-(2,3-dimethylpentan-2-yl)benzoic acid Traditional Name: 4-amino-2-(1,1,2-trimethylbutyl)benzoic acid Formula: C14H21NO2 MolecularWeight: 235.32204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)(C)C1=C(C=CC(=C1)N)C(=O)O

Isomeric SMILES

CCC(C)C(C)(C)C1=C(C=CC(=C1)N)C(=O)O

InChI

InChI=1S/C14H21NO2/c1-5-9(2)14(3,4)12-8-10(15)6-7-11(12)13(16)17/h6-9H,5,15H2,1-4H3,(H,16,17)