phenacyl 4-(3-nitrophenyl)sulfonyloxybenzoate

Systemtic Name: phenacyl 4-(3-nitrophenyl)sulfonyloxybenzoate Openeye Name: phenacyl 4-(3-nitrophenyl)sulfonyloxybenzoate CAS Name: 4-(3-nitrophenyl)sulfonyloxybenzoic acid phenacyl ester IUPAC Name: phenacyl 4-(3-nitrophenyl)sulfonyloxybenzoate Traditional Name: 4-(3-nitrophenyl)sulfonyloxybenzoic acid phenacyl ester Formula: C21H15NO8S MolecularWeight: 441.4107

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15NO8S/c23-20(15-5-2-1-3-6-15)14-29-21(24)16-9-11-18(12-10-16)30-31(27,28)19-8-4-7-17(13-19)22(25)26/h1-13H,14H2