[1,1-bis(oxidanylidene)-4-pyrrolidin-1-yl-thiolan-3-yl] 3-nitrobenzoate

Systemtic Name: [1,1-bis(oxidanylidene)-4-pyrrolidin-1-yl-thiolan-3-yl] 3-nitrobenzoate Openeye Name: (1,1-dioxo-4-pyrrolidin-1-yl-thiolan-3-yl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [1,1-dioxo-4-(1-pyrrolidinyl)-3-thiolanyl] ester IUPAC Name: (1,1-dioxo-4-pyrrolidin-1-ylthiolan-3-yl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (1,1-diketo-4-pyrrolidino-thiolan-3-yl) ester Formula: C15H18N2O6S MolecularWeight: 354.37822

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2CS(=O)(=O)CC2OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2CS(=O)(=O)CC2OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O6S/c18-15(11-4-3-5-12(8-11)17(19)20)23-14-10-24(21,22)9-13(14)16-6-1-2-7-16/h3-5,8,13-14H,1-2,6-7,9-10H2