2-[(2-nitrophenyl)methyl-(2-nitrophenyl)sulfonyl-amino]propanoic acid

Systemtic Name: 2-[(2-nitrophenyl)methyl-(2-nitrophenyl)sulfonyl-amino]propanoic acid Openeye Name: 2-[(2-nitrophenyl)methyl-(2-nitrophenyl)sulfonyl-amino]propanoic acid CAS Name: 2-[(2-nitrophenyl)methyl-(2-nitrophenyl)sulfonylamino]propanoic acid IUPAC Name: 2-[(2-nitrophenyl)methyl-(2-nitrophenyl)sulfonylamino]propanoic acid Traditional Name: 2-[(2-nitrobenzyl)-(2-nitrophenyl)sulfonyl-amino]propionic acid Formula: C16H15N3O8S MolecularWeight: 409.3706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(CC1=CC=CC=C1[N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)O)N(CC1=CC=CC=C1[N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O8S/c1-11(16(20)21)17(10-12-6-2-3-7-13(12)18(22)23)28(26,27)15-9-5-4-8-14(15)19(24)25/h2-9,11H,10H2,1H3,(H,20,21)