bicyclo[3.1.1]hepta-1(6),2,4-triene; but-1-yn-1-amine

Systemtic Name: bicyclo[3.1.1]hepta-1(6),2,4-triene; but-1-yn-1-amine Openeye Name: bicyclo[3.1.1]hepta-1(6),2,4-triene; but-1-yn-1-amine CAS Name: bicyclo[3.1.1]hepta-1(6),2,4-triene; 1-butyn-1-amine IUPAC Name: bicyclo[3.1.1]hepta-1(6),2,4-triene; but-1-yn-1-amine Traditional Name: bicyclo[3.1.1]hepta-1(6),2,4-triene; but-1-ynylamine Formula: C11H13N MolecularWeight: 159.22762

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CN.C1C2=CC1=CC=C2

Isomeric SMILES

CCC#CN.C1C2=CC1=CC=C2

InChI

InChI=1S/C7H6.C4H7N/c1-2-6-4-7(3-1)5-6;1-2-3-4-5/h1-4H,5H2;2,5H2,1H3