(3aS,4R,6aS)-4-but-3-ynyl-2,2,4,5-tetramethyl-1,3,3a,6a-tetrahydropentalene

Systemtic Name: (3aS,4R,6aS)-4-but-3-ynyl-2,2,4,5-tetramethyl-1,3,3a,6a-tetrahydropentalene Openeye Name: (3aS,4R,6aS)-4-but-3-ynyl-2,2,4,5-tetramethyl-1,3,3a,6a-tetrahydropentalene CAS Name: (3aS,4R,6aS)-4-but-3-ynyl-2,2,4,5-tetramethyl-1,3,3a,6a-tetrahydropentalene IUPAC Name: (3aS,4R,6aS)-4-but-3-ynyl-2,2,4,5-tetramethyl-1,3,3a,6a-tetrahydropentalene Traditional Name: (3aS,4R,6aS)-4-but-3-ynyl-2,2,4,5-tetramethyl-1,3,3a,6a-tetrahydropentalene Formula: C16H24 MolecularWeight: 216.36176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2CC(CC2C1(C)CCC#C)(C)C

Isomeric SMILES

CC1=C[C@@H]2CC(C[C@@H]2[C@@]1(C)CCC#C)(C)C

InChI

InChI=1S/C16H24/c1-6-7-8-16(5)12(2)9-13-10-15(3,4)11-14(13)16/h1,9,13-14H,7-8,10-11H2,2-5H3/t13-,14+,16+/m1/s1