[2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-5-yl]methyl 4-nitrobenzenesulfonate

Systemtic Name: [2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-5-yl]methyl 4-nitrobenzenesulfonate Openeye Name: (4-benzyl-2-oxo-oxazolidin-5-yl)methyl 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid [2-oxo-4-(phenylmethyl)-5-oxazolidinyl]methyl ester IUPAC Name: (4-benzyl-2-oxo-1,3-oxazolidin-5-yl)methyl 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid (4-benzyl-2-keto-oxazolidin-5-yl)methyl ester Formula: C17H16N2O7S MolecularWeight: 392.38314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C(OC(=O)N2)COS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2C(OC(=O)N2)COS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O7S/c20-17-18-15(10-12-4-2-1-3-5-12)16(26-17)11-25-27(23,24)14-8-6-13(7-9-14)19(21)22/h1-9,15-16H,10-11H2,(H,18,20)