benzenecarbonitrile; methylbenzene

Systemtic Name: benzenecarbonitrile; methylbenzene Openeye Name: benzonitrile; toluene CAS Name: benzonitrile; toluene IUPAC Name: benzonitrile; toluene Traditional Name: benzonitrile; toluene Formula: C14H13N MolecularWeight: 195.25972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H5N.C7H8/c8-6-7-4-2-1-3-5-7;1-7-5-3-2-4-6-7/h1-5H;2-6H,1H3