2-[(4-iodophenyl)sulfonylamino]-3-(4-nitrophenyl)propanoic acid

Systemtic Name: 2-[(4-iodophenyl)sulfonylamino]-3-(4-nitrophenyl)propanoic acid Openeye Name: 2-[(4-iodophenyl)sulfonylamino]-3-(4-nitrophenyl)propanoic acid CAS Name: 2-[(4-iodophenyl)sulfonylamino]-3-(4-nitrophenyl)propanoic acid IUPAC Name: 2-[(4-iodophenyl)sulfonylamino]-3-(4-nitrophenyl)propanoic acid Traditional Name: 2-[(4-iodophenyl)sulfonylamino]-3-(4-nitrophenyl)propionic acid Formula: C15H13IN2O6S MolecularWeight: 476.24299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)I)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)I)[N+](=O)[O-]

InChI

InChI=1S/C15H13IN2O6S/c16-11-3-7-13(8-4-11)25(23,24)17-14(15(19)20)9-10-1-5-12(6-2-10)18(21)22/h1-8,14,17H,9H2,(H,19,20)