(4-isocyano-4-methylsulfanyl-3-oxidanylidene-1,2-oxazolidin-2-yl) 2-(diphenylmethyl)-5-oxidanylidene-oxolane-2-carboxylate

Systemtic Name: (4-isocyano-4-methylsulfanyl-3-oxidanylidene-1,2-oxazolidin-2-yl) 2-(diphenylmethyl)-5-oxidanylidene-oxolane-2-carboxylate Openeye Name: (4-isocyano-4-methylsulfanyl-3-oxo-isoxazolidin-2-yl) 2-benzhydryl-5-oxo-tetrahydrofuran-2-carboxylate CAS Name: 2-(diphenylmethyl)-5-oxo-2-oxolanecarboxylic acid [4-isocyano-4-(methylthio)-3-oxo-2-isoxazolidinyl] ester IUPAC Name: (4-isocyano-4-methylsulfanyl-3-oxo-1,2-oxazolidin-2-yl) 2-benzhydryl-5-oxooxolane-2-carboxylate Traditional Name: 2-benzhydryl-5-keto-tetrahydrofuran-2-carboxylic acid [4-isocyano-3-keto-4-(methylthio)isoxazolidin-2-yl] ester Formula: C23H20N2O6S MolecularWeight: 452.4797

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1(CON(C1=O)OC(=O)C2(CCC(=O)O2)C(C3=CC=CC=C3)C4=CC=CC=C4)[N+]#[C-]

Isomeric SMILES

CSC1(CON(C1=O)OC(=O)C2(CCC(=O)O2)C(C3=CC=CC=C3)C4=CC=CC=C4)[N+]#[C-]

InChI

InChI=1S/C23H20N2O6S/c1-24-23(32-2)15-29-25(20(23)27)31-21(28)22(14-13-18(26)30-22)19(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,19H,13-15H2,2H3