(4S,5R)-1,2-dibutyl-4-hept-2-ynyl-5-methyl-cyclohexene

Systemtic Name: (4S,5R)-1,2-dibutyl-4-hept-2-ynyl-5-methyl-cyclohexene Openeye Name: (4S,5R)-1,2-dibutyl-4-hept-2-ynyl-5-methyl-cyclohexene CAS Name: (4S,5R)-1,2-dibutyl-4-hept-2-ynyl-5-methylcyclohexene IUPAC Name: (4S,5R)-1,2-dibutyl-4-hept-2-ynyl-5-methylcyclohexene Traditional Name: (4S,5R)-1,2-dibutyl-4-hept-2-ynyl-5-methyl-cyclohexene Formula: C22H38 MolecularWeight: 302.53712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CCC1CC(=C(CC1C)CCCC)CCCC

Isomeric SMILES

CCCCC#CC[C@H]1CC(=C(C[C@H]1C)CCCC)CCCC

InChI

InChI=1S/C22H38/c1-5-8-11-12-13-16-20-18-22(15-10-7-3)21(14-9-6-2)17-19(20)4/h19-20H,5-11,14-18H2,1-4H3/t19-,20+/m1/s1