7-(2-phenylethynyl)bicyclo[2.2.1]hepta-1,3,5-triene; N-propylpropan-1-amine

Systemtic Name: 7-(2-phenylethynyl)bicyclo[2.2.1]hepta-1,3,5-triene; N-propylpropan-1-amine Openeye Name: 7-(2-phenylethynyl)bicyclo[2.2.1]hepta-1,3,5-triene; N-propylpropan-1-amine CAS Name: 7-(2-phenylethynyl)bicyclo[2.2.1]hepta-1,3,5-triene; N-propyl-1-propanamine IUPAC Name: 7-(2-phenylethynyl)bicyclo[2.2.1]hepta-1,3,5-triene; N-propylpropan-1-amine Traditional Name: dipropylamine; 7-(2-phenylethynyl)bicyclo[2.2.1]hepta-1,3,5-triene Formula: C21H25N MolecularWeight: 291.4299

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCCC.C1=CC=C(C=C1)C#CC2C3=CC=C2C=C3

Isomeric SMILES

CCCNCCC.C1=CC=C(C=C1)C#CC2C3=CC=C2C=C3

InChI

InChI=1S/C15H10.C6H15N/c1-2-4-12(5-3-1)6-11-15-13-7-8-14(15)10-9-13;1-3-5-7-6-4-2/h1-5,7-10,15H;7H,3-6H2,1-2H3