(4-propanoylphenyl) 2-(2-nitrophenyl)sulfonylbenzoate

Systemtic Name: (4-propanoylphenyl) 2-(2-nitrophenyl)sulfonylbenzoate Openeye Name: (4-propanoylphenyl) 2-(2-nitrophenyl)sulfonylbenzoate CAS Name: 2-(2-nitrophenyl)sulfonylbenzoic acid [4-(1-oxopropyl)phenyl] ester IUPAC Name: (4-propanoylphenyl) 2-(2-nitrophenyl)sulfonylbenzoate Traditional Name: 2-(2-nitrophenyl)sulfonylbenzoic acid (4-propionylphenyl) ester Formula: C22H17NO7S MolecularWeight: 439.43788

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H17NO7S/c1-2-19(24)15-11-13-16(14-12-15)30-22(25)17-7-3-5-9-20(17)31(28,29)21-10-6-4-8-18(21)23(26)27/h3-14H,2H2,1H3