3-oxidanyl-3-(1-oxidanyl-3-phenyl-propyl)heptan-2-one

Systemtic Name: 3-oxidanyl-3-(1-oxidanyl-3-phenyl-propyl)heptan-2-one Openeye Name: 3-hydroxy-3-(1-hydroxy-3-phenyl-propyl)heptan-2-one CAS Name: 3-hydroxy-3-(1-hydroxy-3-phenylpropyl)-2-heptanone IUPAC Name: 3-hydroxy-3-(1-hydroxy-3-phenylpropyl)heptan-2-one Traditional Name: 3-hydroxy-3-(1-hydroxy-3-phenyl-propyl)heptan-2-one Formula: C16H24O3 MolecularWeight: 264.35996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CCC1=CC=CC=C1)O)(C(=O)C)O

Isomeric SMILES

CCCCC(C(CCC1=CC=CC=C1)O)(C(=O)C)O

InChI

InChI=1S/C16H24O3/c1-3-4-12-16(19,13(2)17)15(18)11-10-14-8-6-5-7-9-14/h5-9,15,18-19H,3-4,10-12H2,1-2H3