methyl (1R,3R)-3-(1,3-benzodioxol-5-yl)-2,2-dicyano-cyclopropane-1-carboxylate

Systemtic Name: methyl (1R,3R)-3-(1,3-benzodioxol-5-yl)-2,2-dicyano-cyclopropane-1-carboxylate Openeye Name: methyl (1R,3R)-3-(1,3-benzodioxol-5-yl)-2,2-dicyano-cyclopropanecarboxylate CAS Name: (1R,3R)-3-(1,3-benzodioxol-5-yl)-2,2-dicyano-1-cyclopropanecarboxylic acid methyl ester IUPAC Name: methyl (1R,3R)-3-(1,3-benzodioxol-5-yl)-2,2-dicyanocyclopropane-1-carboxylate Traditional Name: (1R,3R)-3-(1,3-benzodioxol-5-yl)-2,2-dicyano-cyclopropanecarboxylic acid methyl ester Formula: C14H10N2O4 MolecularWeight: 270.2402

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C1(C#N)C#N)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)[C@@H]1[C@@H](C1(C#N)C#N)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H10N2O4/c1-18-13(17)12-11(14(12,5-15)6-16)8-2-3-9-10(4-8)20-7-19-9/h2-4,11-12H,7H2,1H3/t11-,12-/m0/s1