3-(phenylmethyl)heptan-2-one

Systemtic Name: 3-(phenylmethyl)heptan-2-one Openeye Name: 3-benzylheptan-2-one CAS Name: 3-(phenylmethyl)-2-heptanone IUPAC Name: 3-benzylheptan-2-one Traditional Name: 3-benzylheptan-2-one Formula: C14H20O MolecularWeight: 204.308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=CC=CC=C1)C(=O)C

Isomeric SMILES

CCCCC(CC1=CC=CC=C1)C(=O)C

InChI

InChI=1S/C14H20O/c1-3-4-10-14(12(2)15)11-13-8-6-5-7-9-13/h5-9,14H,3-4,10-11H2,1-2H3