[4-morpholin-4-yl-1,1-bis(oxidanylidene)thiolan-3-yl] 4-chloranyl-3-nitro-benzoate

Systemtic Name: [4-morpholin-4-yl-1,1-bis(oxidanylidene)thiolan-3-yl] 4-chloranyl-3-nitro-benzoate Openeye Name: (4-morpholino-1,1-dioxo-thiolan-3-yl) 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid [4-(4-morpholinyl)-1,1-dioxo-3-thiolanyl] ester IUPAC Name: (4-morpholin-4-yl-1,1-dioxothiolan-3-yl) 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid (1,1-diketo-4-morpholino-thiolan-3-yl) ester Formula: C15H17ClN2O7S MolecularWeight: 404.82268

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2CS(=O)(=O)CC2OC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2CS(=O)(=O)CC2OC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H17ClN2O7S/c16-11-2-1-10(7-12(11)18(20)21)15(19)25-14-9-26(22,23)8-13(14)17-3-5-24-6-4-17/h1-2,7,13-14H,3-6,8-9H2