5-[1-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenyl-ethyl]-1,2,4-oxadiazole-3-carboxylic acid

Systemtic Name: 5-[1-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenyl-ethyl]-1,2,4-oxadiazole-3-carboxylic acid Openeye Name: 5-[1-(tert-butoxycarbonylamino)-2-phenyl-ethyl]-1,2,4-oxadiazole-3-carboxylic acid CAS Name: 5-[1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-phenylethyl]-1,2,4-oxadiazole-3-carboxylic acid IUPAC Name: 5-[1-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylethyl]-1,2,4-oxadiazole-3-carboxylic acid Traditional Name: 5-[1-(tert-butoxycarbonylamino)-2-phenyl-ethyl]-1,2,4-oxadiazole-3-carboxylic acid Formula: C16H19N3O5 MolecularWeight: 333.33916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C2=NC(=NO2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C2=NC(=NO2)C(=O)O

InChI

InChI=1S/C16H19N3O5/c1-16(2,3)23-15(22)17-11(9-10-7-5-4-6-8-10)13-18-12(14(20)21)19-24-13/h4-8,11H,9H2,1-3H3,(H,17,22)(H,20,21)