3-[(3aR,6aR)-4,4,6a-trimethyl-3-oxidanylidene-2,3a,5,6-tetrahydro-1H-pentalen-2-yl]propanenitrile

Systemtic Name: 3-[(3aR,6aR)-4,4,6a-trimethyl-3-oxidanylidene-2,3a,5,6-tetrahydro-1H-pentalen-2-yl]propanenitrile Openeye Name: 3-[(3aR,6aR)-4,4,6a-trimethyl-3-oxo-2,3a,5,6-tetrahydro-1H-pentalen-2-yl]propanenitrile CAS Name: 3-[(3aR,6aR)-4,4,6a-trimethyl-3-oxo-2,3a,5,6-tetrahydro-1H-pentalen-2-yl]propanenitrile IUPAC Name: 3-[(3aR,6aR)-4,4,6a-trimethyl-3-oxo-2,3a,5,6-tetrahydro-1H-pentalen-2-yl]propanenitrile Traditional Name: 3-[(3aR,6aR)-3-keto-4,4,6a-trimethyl-2,3a,5,6-tetrahydro-1H-pentalen-2-yl]propionitrile Formula: C14H21NO MolecularWeight: 219.32264

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2(C1C(=O)C(C2)CCC#N)C)C

Isomeric SMILES

C[C@]12CCC([C@H]1C(=O)C(C2)CCC#N)(C)C

InChI

InChI=1S/C14H21NO/c1-13(2)6-7-14(3)9-10(5-4-8-15)11(16)12(13)14/h10,12H,4-7,9H2,1-3H3/t10?,12-,14-/m1/s1