methyl 5-(4-isocyanophenyl)-2-oxidanylidene-1,3-oxazolidine-4-carboxylate

Systemtic Name: methyl 5-(4-isocyanophenyl)-2-oxidanylidene-1,3-oxazolidine-4-carboxylate Openeye Name: methyl 5-(4-isocyanophenyl)-2-oxo-oxazolidine-4-carboxylate CAS Name: 5-(4-isocyanophenyl)-2-oxo-4-oxazolidinecarboxylic acid methyl ester IUPAC Name: methyl 5-(4-isocyanophenyl)-2-oxo-1,3-oxazolidine-4-carboxylate Traditional Name: 5-(4-isocyanophenyl)-2-keto-oxazolidine-4-carboxylic acid methyl ester Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(OC(=O)N1)C2=CC=C(C=C2)[N+]#[C-]

Isomeric SMILES

COC(=O)C1C(OC(=O)N1)C2=CC=C(C=C2)[N+]#[C-]

InChI

InChI=1S/C12H10N2O4/c1-13-8-5-3-7(4-6-8)10-9(11(15)17-2)14-12(16)18-10/h3-6,9-10H,2H3,(H,14,16)