9-propan-2-ylheptacos-10-yne

Systemtic Name: 9-propan-2-ylheptacos-10-yne Openeye Name: 9-isopropylheptacos-10-yne CAS Name: 9-propan-2-yl-10-heptacosyne IUPAC Name: 9-propan-2-ylheptacos-10-yne Traditional Name: 9-isopropylheptacos-10-yne Formula: C30H58 MolecularWeight: 418.78152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC#CC(CCCCCCCC)C(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCC#CC(CCCCCCCC)C(C)C

InChI

InChI=1S/C30H58/c1-5-7-9-11-13-14-15-16-17-18-19-20-21-22-24-26-28-30(29(3)4)27-25-23-12-10-8-6-2/h29-30H,5-25,27H2,1-4H3