5-methyl-3-[2-(methylamino)-3-(2-methylpropyl)phenyl]-1,2-oxazole-4-carboxylic acid

Systemtic Name: 5-methyl-3-[2-(methylamino)-3-(2-methylpropyl)phenyl]-1,2-oxazole-4-carboxylic acid Openeye Name: 3-[3-isobutyl-2-(methylamino)phenyl]-5-methyl-isoxazole-4-carboxylic acid CAS Name: 5-methyl-3-[2-(methylamino)-3-(2-methylpropyl)phenyl]-4-isoxazolecarboxylic acid IUPAC Name: 5-methyl-3-[2-(methylamino)-3-(2-methylpropyl)phenyl]-1,2-oxazole-4-carboxylic acid Traditional Name: 3-[3-isobutyl-2-(methylamino)phenyl]-5-methyl-isoxazole-4-carboxylic acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C(=CC=C2)CC(C)C)NC)C(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C(=CC=C2)CC(C)C)NC)C(=O)O

InChI

InChI=1S/C16H20N2O3/c1-9(2)8-11-6-5-7-12(14(11)17-4)15-13(16(19)20)10(3)21-18-15/h5-7,9,17H,8H2,1-4H3,(H,19,20)