[2-oxidanylidene-3-(1-phenylazetidin-2-yl)-1,3-oxazolidin-4-yl]methyl 3-nitrobenzenesulfonate

Systemtic Name: [2-oxidanylidene-3-(1-phenylazetidin-2-yl)-1,3-oxazolidin-4-yl]methyl 3-nitrobenzenesulfonate Openeye Name: [2-oxo-3-(1-phenylazetidin-2-yl)oxazolidin-4-yl]methyl 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid [2-oxo-3-(1-phenyl-2-azetidinyl)-4-oxazolidinyl]methyl ester IUPAC Name: [2-oxo-3-(1-phenylazetidin-2-yl)-1,3-oxazolidin-4-yl]methyl 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid [2-keto-3-(1-phenylazetidin-2-yl)oxazolidin-4-yl]methyl ester Formula: C19H19N3O7S MolecularWeight: 433.43506

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1N2C(COC2=O)COS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1CN(C1N2C(COC2=O)COS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C19H19N3O7S/c23-19-21(18-9-10-20(18)14-5-2-1-3-6-14)16(12-28-19)13-29-30(26,27)17-8-4-7-15(11-17)22(24)25/h1-8,11,16,18H,9-10,12-13H2