2-hexadecyl-2-methoxy-1-phenyl-butane-1,3-dione

Systemtic Name: 2-hexadecyl-2-methoxy-1-phenyl-butane-1,3-dione Openeye Name: 2-hexadecyl-2-methoxy-1-phenyl-butane-1,3-dione CAS Name: 2-hexadecyl-2-methoxy-1-phenylbutane-1,3-dione IUPAC Name: 2-hexadecyl-2-methoxy-1-phenylbutane-1,3-dione Traditional Name: 2-cetyl-2-methoxy-1-phenyl-butane-1,3-dione Formula: C27H44O3 MolecularWeight: 416.63646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(=O)C)(C(=O)C1=CC=CC=C1)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(=O)C)(C(=O)C1=CC=CC=C1)OC

InChI

InChI=1S/C27H44O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-27(30-3,24(2)28)26(29)25-21-18-17-19-22-25/h17-19,21-22H,4-16,20,23H2,1-3H3