benzene; 1,3-dimethylbenzene; methylbenzene

Systemtic Name: benzene; 1,3-dimethylbenzene; methylbenzene Openeye Name: benzene; m-xylene; toluene CAS Name: benzene; toluene; 1,3-xylene IUPAC Name: benzene; toluene; 1,3-xylene Traditional Name: benzene; m-xylene; toluene Formula: C21H24 MolecularWeight: 276.41526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.CC1=CC(=CC=C1)C.C1=CC=CC=C1

Isomeric SMILES

CC1=CC=CC=C1.CC1=CC(=CC=C1)C.C1=CC=CC=C1

InChI

InChI=1S/C8H10.C7H8.C6H6/c1-7-4-3-5-8(2)6-7;1-7-5-3-2-4-6-7;1-2-4-6-5-3-1/h3-6H,1-2H3;2-6H,1H3;1-6H