(E)-3-(1-adamantyl)-2-cyano-but-2-enoic acid

Systemtic Name: (E)-3-(1-adamantyl)-2-cyano-but-2-enoic acid Openeye Name: (E)-3-(1-adamantyl)-2-cyano-but-2-enoic acid CAS Name: (E)-3-(1-adamantyl)-2-cyano-2-butenoic acid IUPAC Name: (E)-3-(1-adamantyl)-2-cyanobut-2-enoic acid Traditional Name: (E)-3-(1-adamantyl)-2-cyano-but-2-enoic acid Formula: C15H19NO2 MolecularWeight: 245.31686

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)O)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

C/C(=C(/C#N)\C(=O)O)/C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C15H19NO2/c1-9(13(8-16)14(17)18)15-5-10-2-11(6-15)4-12(3-10)7-15/h10-12H,2-7H2,1H3,(H,17,18)/b13-9+