heptane; 1-(2-methylphenyl)ethanone

Systemtic Name: heptane; 1-(2-methylphenyl)ethanone Openeye Name: heptane; 1-(o-tolyl)ethanone CAS Name: heptane; 1-(2-methylphenyl)ethanone IUPAC Name: heptane; 1-(2-methylphenyl)ethanone Traditional Name: n-heptane; 1-(o-tolyl)ethanone Formula: C16H26O MolecularWeight: 234.37704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC.CC1=CC=CC=C1C(=O)C

Isomeric SMILES

CCCCCCC.CC1=CC=CC=C1C(=O)C

InChI

InChI=1S/C9H10O.C7H16/c1-7-5-3-4-6-9(7)8(2)10;1-3-5-7-6-4-2/h3-6H,1-2H3;3-7H2,1-2H3