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

Systemtic Name: [4-(hydroxymethyl)-4-isocyano-3-oxidanylidene-1,2-oxazolidin-2-yl] 2-(diphenylmethyl)-5-oxidanylidene-oxolane-2-carboxylate Openeye Name: [4-(hydroxymethyl)-4-isocyano-3-oxo-isoxazolidin-2-yl] 2-benzhydryl-5-oxo-tetrahydrofuran-2-carboxylate CAS Name: 2-(diphenylmethyl)-5-oxo-2-oxolanecarboxylic acid [4-(hydroxymethyl)-4-isocyano-3-oxo-2-isoxazolidinyl] ester IUPAC Name: [4-(hydroxymethyl)-4-isocyano-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-methylol-isoxazolidin-2-yl) ester Formula: C23H20N2O7 MolecularWeight: 436.4141

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N2O7/c1-24-22(14-26)15-30-25(20(22)28)32-21(29)23(13-12-18(27)31-23)19(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,19,26H,12-15H2