(1-oxidanylcyclohexyl)-phenyl-methanone; 1-phenylethanone

Systemtic Name: (1-oxidanylcyclohexyl)-phenyl-methanone; 1-phenylethanone Openeye Name: (1-hydroxycyclohexyl)-phenyl-methanone; 1-phenylethanone CAS Name: (1-hydroxycyclohexyl)-phenylmethanone; 1-phenylethanone IUPAC Name: (1-hydroxycyclohexyl)-phenylmethanone; 1-phenylethanone Traditional Name: acetophenone; (1-hydroxycyclohexyl)-phenyl-methanone Formula: C21H24O3 MolecularWeight: 324.41346

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1.C1CCC(CC1)(C(=O)C2=CC=CC=C2)O

Isomeric SMILES

CC(=O)C1=CC=CC=C1.C1CCC(CC1)(C(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C13H16O2.C8H8O/c14-12(11-7-3-1-4-8-11)13(15)9-5-2-6-10-13;1-7(9)8-5-3-2-4-6-8/h1,3-4,7-8,15H,2,5-6,9-10H2;2-6H,1H3