2-[[4-[(4-chloranyl-2-nitro-phenyl)carbonylamino]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[(4-chloranyl-2-nitro-phenyl)carbonylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[(4-chloro-2-nitro-benzoyl)amino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[(4-chloro-2-nitrophenyl)-oxomethyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[(4-chloro-2-nitrobenzoyl)amino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[(4-chloro-2-nitro-benzoyl)amino]phenyl]sulfonylamino]acetic acid Formula: C15H12ClN3O7S MolecularWeight: 413.78968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)NCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C15H12ClN3O7S/c16-9-1-6-12(13(7-9)19(23)24)15(22)18-10-2-4-11(5-3-10)27(25,26)17-8-14(20)21/h1-7,17H,8H2,(H,18,22)(H,20,21)