2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(2-nitrophenyl)sulfonylamino]propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(2-nitrophenyl)sulfonylamino]propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-[(2-nitrophenyl)sulfonylamino]propanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[(2-nitrophenyl)sulfonylamino]propanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(2-nitrophenyl)sulfonylamino]propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-[(2-nitrophenyl)sulfonylamino]propionic acid Formula: C14H19N3O8S MolecularWeight: 389.38096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O8S/c1-14(2,3)25-13(20)16-9(12(18)19)8-15-26(23,24)11-7-5-4-6-10(11)17(21)22/h4-7,9,15H,8H2,1-3H3,(H,16,20)(H,18,19)