1-butyl-3-hexyl-2-hex-1-ynyl-5-methyl-benzene

Systemtic Name: 1-butyl-3-hexyl-2-hex-1-ynyl-5-methyl-benzene Openeye Name: 1-butyl-3-hexyl-2-hex-1-ynyl-5-methyl-benzene CAS Name: 1-butyl-3-hexyl-2-hex-1-ynyl-5-methylbenzene IUPAC Name: 1-butyl-3-hexyl-2-hex-1-ynyl-5-methylbenzene Traditional Name: 1-butyl-3-hexyl-2-hex-1-ynyl-5-methyl-benzene Formula: C23H36 MolecularWeight: 312.53194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=CC(=C1C#CCCCC)CCCC)C

Isomeric SMILES

CCCCCCC1=CC(=CC(=C1C#CCCCC)CCCC)C

InChI

InChI=1S/C23H36/c1-5-8-11-13-16-22-19-20(4)18-21(15-10-7-3)23(22)17-14-12-9-6-2/h18-19H,5-13,15-16H2,1-4H3