phenacyl 5-(azetidin-1-ylsulfonyl)-2,4-bis(chloranyl)benzoate

Systemtic Name: phenacyl 5-(azetidin-1-ylsulfonyl)-2,4-bis(chloranyl)benzoate Openeye Name: phenacyl 5-(azetidin-1-ylsulfonyl)-2,4-dichloro-benzoate CAS Name: 5-(1-azetidinylsulfonyl)-2,4-dichlorobenzoic acid phenacyl ester IUPAC Name: phenacyl 5-(azetidin-1-ylsulfonyl)-2,4-dichlorobenzoate Traditional Name: 5-(azetidin-1-ylsulfonyl)-2,4-dichloro-benzoic acid phenacyl ester Formula: C18H15Cl2NO5S MolecularWeight: 428.2864

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)S(=O)(=O)C2=C(C=C(C(=C2)C(=O)OCC(=O)C3=CC=CC=C3)Cl)Cl

Isomeric SMILES

C1CN(C1)S(=O)(=O)C2=C(C=C(C(=C2)C(=O)OCC(=O)C3=CC=CC=C3)Cl)Cl

InChI

InChI=1S/C18H15Cl2NO5S/c19-14-10-15(20)17(27(24,25)21-7-4-8-21)9-13(14)18(23)26-11-16(22)12-5-2-1-3-6-12/h1-3,5-6,9-10H,4,7-8,11H2