[1-imidazol-1-yl-3-(phenylsulfonyl)propan-2-yl] 2,4-bis(chloranyl)benzoate

Systemtic Name: [1-imidazol-1-yl-3-(phenylsulfonyl)propan-2-yl] 2,4-bis(chloranyl)benzoate Openeye Name: [1-(benzenesulfonylmethyl)-2-imidazol-1-yl-ethyl] 2,4-dichlorobenzoate CAS Name: 2,4-dichlorobenzoic acid [1-(benzenesulfonyl)-3-(1-imidazolyl)propan-2-yl] ester IUPAC Name: [1-(benzenesulfonyl)-3-imidazol-1-ylpropan-2-yl] 2,4-dichlorobenzoate Traditional Name: 2,4-dichlorobenzoic acid [1-(besylmethyl)-2-imidazol-1-yl-ethyl] ester Formula: C19H16Cl2N2O4S MolecularWeight: 439.31234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CC(CN2C=CN=C2)OC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CC(CN2C=CN=C2)OC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H16Cl2N2O4S/c20-14-6-7-17(18(21)10-14)19(24)27-15(11-23-9-8-22-13-23)12-28(25,26)16-4-2-1-3-5-16/h1-10,13,15H,11-12H2