5-methyl-4-[[(phenylmethyl)amino]methyl]-1,2-oxazole-3-carboxylic acid

Systemtic Name: 5-methyl-4-[[(phenylmethyl)amino]methyl]-1,2-oxazole-3-carboxylic acid Openeye Name: 4-[(benzylamino)methyl]-5-methyl-isoxazole-3-carboxylic acid CAS Name: 5-methyl-4-[[(phenylmethyl)amino]methyl]-3-isoxazolecarboxylic acid IUPAC Name: 4-[(benzylamino)methyl]-5-methyl-1,2-oxazole-3-carboxylic acid Traditional Name: 4-[(benzylamino)methyl]-5-methyl-isoxazole-3-carboxylic acid Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C(=O)O)CNCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NO1)C(=O)O)CNCC2=CC=CC=C2

InChI

InChI=1S/C13H14N2O3/c1-9-11(12(13(16)17)15-18-9)8-14-7-10-5-3-2-4-6-10/h2-6,14H,7-8H2,1H3,(H,16,17)