[2-(dimethylamino)-5-nitro-phenyl] 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: [2-(dimethylamino)-5-nitro-phenyl] 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: [2-(dimethylamino)-5-nitro-phenyl] 3-(tert-butoxycarbonylamino)propanoate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid [2-(dimethylamino)-5-nitrophenyl] ester IUPAC Name: [2-(dimethylamino)-5-nitrophenyl] 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 3-(tert-butoxycarbonylamino)propionic acid [2-(dimethylamino)-5-nitro-phenyl] ester Formula: C16H23N3O6 MolecularWeight: 353.37032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)OC1=C(C=CC(=C1)[N+](=O)[O-])N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)OC1=C(C=CC(=C1)[N+](=O)[O-])N(C)C

InChI

InChI=1S/C16H23N3O6/c1-16(2,3)25-15(21)17-9-8-14(20)24-13-10-11(19(22)23)6-7-12(13)18(4)5/h6-7,10H,8-9H2,1-5H3,(H,17,21)