methanenitrile; (2E)-2-(3,5,5-trimethylcyclohex-2-en-1-ylidene)propanenitrile

Systemtic Name: methanenitrile; (2E)-2-(3,5,5-trimethylcyclohex-2-en-1-ylidene)propanenitrile Openeye Name: formonitrile; (2E)-2-(3,5,5-trimethylcyclohex-2-en-1-ylidene)propanenitrile CAS Name: formonitrile; (2E)-2-(3,5,5-trimethyl-1-cyclohex-2-enylidene)propanenitrile IUPAC Name: formonitrile; (2E)-2-(3,5,5-trimethylcyclohex-2-en-1-ylidene)propanenitrile Traditional Name: hydrogen cyanide; (2E)-2-(3,5,5-trimethylcyclohex-2-en-1-ylidene)propionitrile Formula: C13H18N2 MolecularWeight: 202.29542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N.CHN/c1-9-5-11(10(2)8-13)7-12(3,4)6-9;1-2/h5H,6-7H2,1-4H3;1H/b11-10-;