bicyclo[2.2.0]hexa-1(4),2,5-trien-3-amine; ethanenitrile

Systemtic Name: bicyclo[2.2.0]hexa-1(4),2,5-trien-3-amine; ethanenitrile Openeye Name: acetonitrile; bicyclo[2.2.0]hexa-1(4),2,5-trien-3-amine CAS Name: acetonitrile; 3-bicyclo[2.2.0]hexa-1(4),2,5-trienamine IUPAC Name: acetonitrile; bicyclo[2.2.0]hexa-1(4),2,5-trien-3-amine Traditional Name: acetonitrile; 3-bicyclo[2.2.0]hexa-1(4),2,5-trienylamine Formula: C8H8N2 MolecularWeight: 132.16252

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.C1=CC2=C1C=C2N

Isomeric SMILES

CC#N.C1=CC2=C1C=C2N

InChI

InChI=1S/C6H5N.C2H3N/c7-6-3-4-1-2-5(4)6;1-2-3/h1-3H,7H2;1H3