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

Systemtic Name: 2-[[4-[(2-chloranyl-4-nitro-phenyl)carbonylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[(2-chloro-4-nitro-benzoyl)amino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[(2-chloro-4-nitrophenyl)-oxomethyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[(2-chloro-4-nitrobenzoyl)amino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[(2-chloro-4-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)[N+](=O)[O-])Cl)S(=O)(=O)NCC(=O)O

Isomeric SMILES

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

InChI

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