4-chloranyl-4-[[5-(hydroxymethyl)-6-oxidanyl-2-oxidanylidene-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]oxazol-3-yl]methyl]-5-oxidanylidene-pyrrolidine-2-carbonitrile

Systemtic Name: 4-chloranyl-4-[[5-(hydroxymethyl)-6-oxidanyl-2-oxidanylidene-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]oxazol-3-yl]methyl]-5-oxidanylidene-pyrrolidine-2-carbonitrile Openeye Name: 4-chloro-4-[[6-hydroxy-5-(hydroxymethyl)-2-oxo-3a,5,6,6a-tetrahydrofuro[2,3-d]oxazol-3-yl]methyl]-5-oxo-pyrrolidine-2-carbonitrile CAS Name: 4-chloro-4-[[6-hydroxy-5-(hydroxymethyl)-2-oxo-3a,5,6,6a-tetrahydrofuro[2,3-d]oxazol-3-yl]methyl]-5-oxo-2-pyrrolidinecarbonitrile IUPAC Name: 4-chloro-4-[[6-hydroxy-5-(hydroxymethyl)-2-oxo-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]oxazol-3-yl]methyl]-5-oxopyrrolidine-2-carbonitrile Traditional Name: 4-chloro-4-[(6-hydroxy-2-keto-5-methylol-3a,5,6,6a-tetrahydrofuro[2,3-d]oxazol-3-yl)methyl]-5-keto-pyrrolidine-2-carbonitrile Formula: C12H14ClN3O6 MolecularWeight: 331.70906

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)C1(CN2C3C(C(C(O3)CO)O)OC2=O)Cl)C#N

Isomeric SMILES

C1C(NC(=O)C1(CN2C3C(C(C(O3)CO)O)OC2=O)Cl)C#N

InChI

InChI=1S/C12H14ClN3O6/c13-12(1-5(2-14)15-10(12)19)4-16-9-8(22-11(16)20)7(18)6(3-17)21-9/h5-9,17-18H,1,3-4H2,(H,15,19)