azane; 1,3-dimethylbenzene; 2-methylpropanenitrile

Systemtic Name: azane; 1,3-dimethylbenzene; 2-methylpropanenitrile Openeye Name: ammonia; 2-methylpropanenitrile; m-xylene CAS Name: ammonia; 2-methylpropanenitrile; 1,3-xylene IUPAC Name: azane; 2-methylpropanenitrile; 1,3-xylene Traditional Name: ammonia; isobutyronitrile; m-xylene Formula: C16H30N4 MolecularWeight: 278.4362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10.2C4H7N.2H3N/c1-7-4-3-5-8(2)6-7;2*1-4(2)3-5;;/h3-6H,1-2H3;2*4H,1-2H3;2*1H3