3-[[4-[2-(4-nitrophenoxy)ethanoylamino]phenyl]sulfonylamino]propanoic acid

Systemtic Name: 3-[[4-[2-(4-nitrophenoxy)ethanoylamino]phenyl]sulfonylamino]propanoic acid Openeye Name: 3-[[4-[[2-(4-nitrophenoxy)acetyl]amino]phenyl]sulfonylamino]propanoic acid CAS Name: 3-[[4-[[2-(4-nitrophenoxy)-1-oxoethyl]amino]phenyl]sulfonylamino]propanoic acid IUPAC Name: 3-[[4-[[2-(4-nitrophenoxy)acetyl]amino]phenyl]sulfonylamino]propanoic acid Traditional Name: 3-[[4-[[2-(4-nitrophenoxy)acetyl]amino]phenyl]sulfonylamino]propionic acid Formula: C17H17N3O8S MolecularWeight: 423.39718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)NCCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)NCCC(=O)O

InChI

InChI=1S/C17H17N3O8S/c21-16(11-28-14-5-3-13(4-6-14)20(24)25)19-12-1-7-15(8-2-12)29(26,27)18-10-9-17(22)23/h1-8,18H,9-11H2,(H,19,21)(H,22,23)