methyl (1S,3R)-1,2,2-tricyano-3-(2-methylpropoxy)cyclobutane-1-carboxylate

Systemtic Name: methyl (1S,3R)-1,2,2-tricyano-3-(2-methylpropoxy)cyclobutane-1-carboxylate Openeye Name: methyl (1S,3R)-1,2,2-tricyano-3-isobutoxy-cyclobutanecarboxylate CAS Name: (1S,3R)-1,2,2-tricyano-3-(2-methylpropoxy)-1-cyclobutanecarboxylic acid methyl ester IUPAC Name: methyl (1S,3R)-1,2,2-tricyano-3-(2-methylpropoxy)cyclobutane-1-carboxylate Traditional Name: (1S,3R)-1,2,2-tricyano-3-isobutoxy-cyclobutanecarboxylic acid methyl ester Formula: C13H15N3O3 MolecularWeight: 261.2765

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1CC(C1(C#N)C#N)(C#N)C(=O)OC

Isomeric SMILES

CC(C)CO[C@@H]1C[C@](C1(C#N)C#N)(C#N)C(=O)OC

InChI

InChI=1S/C13H15N3O3/c1-9(2)5-19-10-4-12(6-14,11(17)18-3)13(10,7-15)8-16/h9-10H,4-5H2,1-3H3/t10-,12+/m1/s1