phenacyl 2-[(2-chloranyl-5-nitro-phenyl)sulfonylamino]benzoate

Systemtic Name: phenacyl 2-[(2-chloranyl-5-nitro-phenyl)sulfonylamino]benzoate Openeye Name: phenacyl 2-[(2-chloro-5-nitro-phenyl)sulfonylamino]benzoate CAS Name: 2-[(2-chloro-5-nitrophenyl)sulfonylamino]benzoic acid phenacyl ester IUPAC Name: phenacyl 2-[(2-chloro-5-nitrophenyl)sulfonylamino]benzoate Traditional Name: 2-[(2-chloro-5-nitro-phenyl)sulfonylamino]benzoic acid phenacyl ester Formula: C21H15ClN2O7S MolecularWeight: 474.871

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H15ClN2O7S/c22-17-11-10-15(24(27)28)12-20(17)32(29,30)23-18-9-5-4-8-16(18)21(26)31-13-19(25)14-6-2-1-3-7-14/h1-12,23H,13H2