1-(2-azanylethylamino)propan-2-ol; 7-oxabicyclo[4.1.0]hepta-1,3,5-triene-5-carbonitrile

Systemtic Name: 1-(2-azanylethylamino)propan-2-ol; 7-oxabicyclo[4.1.0]hepta-1,3,5-triene-5-carbonitrile Openeye Name: 1-(2-aminoethylamino)propan-2-ol; 7-oxabicyclo[4.1.0]hepta-1,3,5-triene-5-carbonitrile CAS Name: 1-(2-aminoethylamino)-2-propanol; 7-oxabicyclo[4.1.0]hepta-1,3,5-triene-5-carbonitrile IUPAC Name: 1-(2-aminoethylamino)propan-2-ol; 7-oxabicyclo[4.1.0]hepta-1,3,5-triene-5-carbonitrile Traditional Name: 1-(2-aminoethylamino)propan-2-ol; 7-oxabicyclo[4.1.0]hepta-1,3,5-triene-5-carbonitrile Formula: C12H17N3O2 MolecularWeight: 235.28228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNCCN)O.C1=CC(=C2C(=C1)O2)C#N

Isomeric SMILES

CC(CNCCN)O.C1=CC(=C2C(=C1)O2)C#N

InChI

InChI=1S/C7H3NO.C5H14N2O/c8-4-5-2-1-3-6-7(5)9-6;1-5(8)4-7-3-2-6/h1-3H;5,7-8H,2-4,6H2,1H3