2-[(2-methylpropan-2-yl)oxycarbonyl-(4-nitrophenyl)amino]propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-(4-nitrophenyl)amino]propanoic acid Openeye Name: 2-(N-tert-butoxycarbonyl-4-nitro-anilino)propanoic acid CAS Name: 2-(N-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-nitroanilino)propanoic acid IUPAC Name: 2-[N-[(2-methylpropan-2-yl)oxycarbonyl]-4-nitroanilino]propanoic acid Traditional Name: 2-(N-tert-butoxycarbonyl-4-nitro-anilino)propionic acid Formula: C14H18N2O6 MolecularWeight: 310.30252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC(C)(C)C

Isomeric SMILES

CC(C(=O)O)N(C1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC(C)(C)C

InChI

InChI=1S/C14H18N2O6/c1-9(12(17)18)15(13(19)22-14(2,3)4)10-5-7-11(8-6-10)16(20)21/h5-9H,1-4H3,(H,17,18)