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

Systemtic Name: [4-(diethylamino)-1,1-bis(oxidanylidene)thiolan-3-yl] 4-chloranyl-3-nitro-benzoate Openeye Name: [4-(diethylamino)-1,1-dioxo-thiolan-3-yl] 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid [4-(diethylamino)-1,1-dioxo-3-thiolanyl] ester IUPAC Name: [4-(diethylamino)-1,1-dioxothiolan-3-yl] 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid [4-(diethylamino)-1,1-diketo-thiolan-3-yl] ester Formula: C15H19ClN2O6S MolecularWeight: 390.83916

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1CS(=O)(=O)CC1OC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1CS(=O)(=O)CC1OC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H19ClN2O6S/c1-3-17(4-2)13-8-25(22,23)9-14(13)24-15(19)10-5-6-11(16)12(7-10)18(20)21/h5-7,13-14H,3-4,8-9H2,1-2H3