4-(4-tert-butylphenyl)-4-oxidanylidene-2-(pyridin-3-ylmethylamino)butanoic acid

Systemtic Name: 4-(4-tert-butylphenyl)-4-oxidanylidene-2-(pyridin-3-ylmethylamino)butanoic acid Openeye Name: 4-(4-tert-butylphenyl)-4-oxo-2-(3-pyridylmethylamino)butanoic acid CAS Name: 4-(4-tert-butylphenyl)-4-oxo-2-(3-pyridinylmethylamino)butanoic acid IUPAC Name: 4-(4-tert-butylphenyl)-4-oxo-2-(pyridin-3-ylmethylamino)butanoic acid Traditional Name: 4-(4-tert-butylphenyl)-4-keto-2-(3-pyridylmethylamino)butyric acid Formula: C20H24N2O3 MolecularWeight: 340.41616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CC(C(=O)O)NCC2=CN=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CC(C(=O)O)NCC2=CN=CC=C2

InChI

InChI=1S/C20H24N2O3/c1-20(2,3)16-8-6-15(7-9-16)18(23)11-17(19(24)25)22-13-14-5-4-10-21-12-14/h4-10,12,17,22H,11,13H2,1-3H3,(H,24,25)