methylbenzene; 1-methyl-4-phenoxy-benzene

Systemtic Name: methylbenzene; 1-methyl-4-phenoxy-benzene Openeye Name: 1-methyl-4-phenoxy-benzene; toluene CAS Name: 1-methyl-4-phenoxybenzene; toluene IUPAC Name: 1-methyl-4-phenoxybenzene; toluene Traditional Name: 1-methyl-4-phenoxy-benzene; toluene Formula: C20H20O MolecularWeight: 276.3722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.CC1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC=C1.CC1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C13H12O.C7H8/c1-11-7-9-13(10-8-11)14-12-5-3-2-4-6-12;1-7-5-3-2-4-6-7/h2-10H,1H3;2-6H,1H3