4-[[2,2-dimethylpropanoyl(pyridin-4-ylmethyl)amino]methyl]benzoic acid

Systemtic Name: 4-[[2,2-dimethylpropanoyl(pyridin-4-ylmethyl)amino]methyl]benzoic acid Openeye Name: 4-[[2,2-dimethylpropanoyl(4-pyridylmethyl)amino]methyl]benzoic acid CAS Name: 4-[[(2,2-dimethyl-1-oxopropyl)-(pyridin-4-ylmethyl)amino]methyl]benzoic acid IUPAC Name: 4-[[2,2-dimethylpropanoyl(pyridin-4-ylmethyl)amino]methyl]benzoic acid Traditional Name: 4-[[pivaloyl(4-pyridylmethyl)amino]methyl]benzoic acid Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N(CC1=CC=C(C=C1)C(=O)O)CC2=CC=NC=C2

Isomeric SMILES

CC(C)(C)C(=O)N(CC1=CC=C(C=C1)C(=O)O)CC2=CC=NC=C2

InChI

InChI=1S/C19H22N2O3/c1-19(2,3)18(24)21(13-15-8-10-20-11-9-15)12-14-4-6-16(7-5-14)17(22)23/h4-11H,12-13H2,1-3H3,(H,22,23)