chloranylbenzene; 4-methylpentan-2-one

Systemtic Name: chloranylbenzene; 4-methylpentan-2-one Openeye Name: chlorobenzene; 4-methylpentan-2-one CAS Name: chlorobenzene; 4-methyl-2-pentanone IUPAC Name: chlorobenzene; 4-methylpentan-2-one Traditional Name: chlorobenzene; 4-methylpentan-2-one Formula: C12H17ClO MolecularWeight: 212.71578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H5Cl.C6H12O/c7-6-4-2-1-3-5-6;1-5(2)4-6(3)7/h1-5H;5H,4H2,1-3H3