3-[2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]-5-(phenylmethyl)-4H-1,2-oxazole-5-carboxylic acid

Systemtic Name: 3-[2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]-5-(phenylmethyl)-4H-1,2-oxazole-5-carboxylic acid Openeye Name: 5-benzyl-3-[1-(tert-butoxycarbonylamino)-2-methyl-propyl]-4H-isoxazole-5-carboxylic acid CAS Name: 3-[2-methyl-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propyl]-5-(phenylmethyl)-4H-isoxazole-5-carboxylic acid IUPAC Name: 5-benzyl-3-[2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]-4H-1,2-oxazole-5-carboxylic acid Traditional Name: 5-benzyl-3-[1-(tert-butoxycarbonylamino)-2-methyl-propyl]-2-isoxazoline-5-carboxylic acid Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=NOC(C1)(CC2=CC=CC=C2)C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C(C1=NOC(C1)(CC2=CC=CC=C2)C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H28N2O5/c1-13(2)16(21-18(25)26-19(3,4)5)15-12-20(17(23)24,27-22-15)11-14-9-7-6-8-10-14/h6-10,13,16H,11-12H2,1-5H3,(H,21,25)(H,23,24)