4-[[butan-2-yl(methyl)amino]methyl]benzoic acid

Systemtic Name: 4-[[butan-2-yl(methyl)amino]methyl]benzoic acid Openeye Name: 4-[[methyl(sec-butyl)amino]methyl]benzoic acid CAS Name: 4-[[butan-2-yl(methyl)amino]methyl]benzoic acid IUPAC Name: 4-[[butan-2-yl(methyl)amino]methyl]benzoic acid Traditional Name: 4-[[methyl(sec-butyl)amino]methyl]benzoic acid Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C)CC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCC(C)N(C)CC1=CC=C(C=C1)C(=O)O

InChI

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