3-(7-bromanyl-2-butyl-heptyl)-3-ethyl-pentadecan-2-one

Systemtic Name: 3-(7-bromanyl-2-butyl-heptyl)-3-ethyl-pentadecan-2-one Openeye Name: 3-(7-bromo-2-butyl-heptyl)-3-ethyl-pentadecan-2-one CAS Name: 3-(7-bromo-2-butylheptyl)-3-ethyl-2-pentadecanone IUPAC Name: 3-(7-bromo-2-butylheptyl)-3-ethylpentadecan-2-one Traditional Name: 3-(7-bromo-2-butyl-heptyl)-3-ethyl-pentadecan-2-one Formula: C28H55BrO MolecularWeight: 487.6397

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CC)(CC(CCCC)CCCCCBr)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCC(CC)(CC(CCCC)CCCCCBr)C(=O)C

InChI

InChI=1S/C28H55BrO/c1-5-8-10-11-12-13-14-15-16-19-23-28(7-3,26(4)30)25-27(21-9-6-2)22-18-17-20-24-29/h27H,5-25H2,1-4H3