butan-2-one; pentan-3-one; 1-phenylethanone

Systemtic Name: butan-2-one; pentan-3-one; 1-phenylethanone Openeye Name: butan-2-one; pentan-3-one; 1-phenylethanone CAS Name: 2-butanone; 3-pentanone; 1-phenylethanone IUPAC Name: butan-2-one; pentan-3-one; 1-phenylethanone Traditional Name: acetophenone; butan-2-one; pentan-3-one Formula: C17H26O3 MolecularWeight: 278.38654

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C.CCC(=O)CC.CC(=O)C1=CC=CC=C1

Isomeric SMILES

CCC(=O)C.CCC(=O)CC.CC(=O)C1=CC=CC=C1

InChI

InChI=1S/C8H8O.C5H10O.C4H8O/c1-7(9)8-5-3-2-4-6-8;1-3-5(6)4-2;1-3-4(2)5/h2-6H,1H3;3-4H2,1-2H3;3H2,1-2H3