(2-chloranyl-4-nitro-phenyl) 2-(4-aminocarbonyl-2-nitro-phenyl)sulfanylethanoate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 2-(4-aminocarbonyl-2-nitro-phenyl)sulfanylethanoate Openeye Name: (2-chloro-4-nitro-phenyl) 2-(4-carbamoyl-2-nitro-phenyl)sulfanylacetate CAS Name: 2-[(4-carbamoyl-2-nitrophenyl)thio]acetic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 2-(4-carbamoyl-2-nitrophenyl)sulfanylacetate Traditional Name: 2-[(4-carbamoyl-2-nitro-phenyl)thio]acetic acid (2-chloro-4-nitro-phenyl) ester Formula: C15H10ClN3O7S MolecularWeight: 411.7738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])SCC(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])SCC(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H10ClN3O7S/c16-10-6-9(18(22)23)2-3-12(10)26-14(20)7-27-13-4-1-8(15(17)21)5-11(13)19(24)25/h1-6H,7H2,(H2,17,21)