N-[3-(1,3-benzodioxol-5-yl)prop-2-ynoxy]-1-azabicyclo[2.2.1]heptan-3-imine

Systemtic Name: N-[3-(1,3-benzodioxol-5-yl)prop-2-ynoxy]-1-azabicyclo[2.2.1]heptan-3-imine Openeye Name: N-[3-(1,3-benzodioxol-5-yl)prop-2-ynoxy]-1-azabicyclo[2.2.1]heptan-3-imine CAS Name: N-[3-(1,3-benzodioxol-5-yl)prop-2-ynoxy]-1-azabicyclo[2.2.1]heptan-3-imine IUPAC Name: N-[3-(1,3-benzodioxol-5-yl)prop-2-ynoxy]-1-azabicyclo[2.2.1]heptan-3-imine Traditional Name: (Z)-1-azabicyclo[2.2.1]heptan-3-ylidene-[3-(1,3-benzodioxol-5-yl)prop-2-ynoxy]amine Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CC1C(=NOCC#CC3=CC4=C(C=C3)OCO4)C2

Isomeric SMILES

C1CN2CC1/C(=N/OCC#CC3=CC4=C(C=C3)OCO4)/C2

InChI

InChI=1S/C16H16N2O3/c1(2-12-3-4-15-16(8-12)20-11-19-15)7-21-17-14-10-18-6-5-13(14)9-18/h3-4,8,13H,5-7,9-11H2/b17-14+