4-(2-methylpentan-3-ylamino)benzoic acid

Systemtic Name: 4-(2-methylpentan-3-ylamino)benzoic acid Openeye Name: 4-[(1-ethyl-2-methyl-propyl)amino]benzoic acid CAS Name: 4-(2-methylpentan-3-ylamino)benzoic acid IUPAC Name: 4-(2-methylpentan-3-ylamino)benzoic acid Traditional Name: 4-[(1-ethyl-2-methyl-propyl)amino]benzoic acid Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C)NC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCC(C(C)C)NC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C13H19NO2/c1-4-12(9(2)3)14-11-7-5-10(6-8-11)13(15)16/h5-9,12,14H,4H2,1-3H3,(H,15,16)