(E)-azepin-3-ylidene(pyridin-3-ylmethoxy)methanamine

Systemtic Name: (E)-azepin-3-ylidene(pyridin-3-ylmethoxy)methanamine Openeye Name: (E)-azepin-3-ylidene(3-pyridylmethoxy)methanamine CAS Name: (E)-3-azepinylidene(3-pyridinylmethoxy)methanamine IUPAC Name: (E)-azepin-3-ylidene(pyridin-3-ylmethoxy)methanamine Traditional Name: [(E)-azepin-3-ylidene(3-pyridylmethoxy)methyl]amine Formula: C13H13N3O MolecularWeight: 227.26182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N)OCC2=CN=CC=C2)C=NC=C1

Isomeric SMILES

C1=C/C(=C(/N)\OCC2=CN=CC=C2)/C=NC=C1

InChI

InChI=1S/C13H13N3O/c14-13(12-5-1-2-6-16-9-12)17-10-11-4-3-7-15-8-11/h1-9H,10,14H2/b13-12+