(2E)-2-(azepan-2-ylidene)-2-(4-methoxyphenyl)ethanenitrile

Systemtic Name: (2E)-2-(azepan-2-ylidene)-2-(4-methoxyphenyl)ethanenitrile Openeye Name: (2E)-2-(azepan-2-ylidene)-2-(4-methoxyphenyl)acetonitrile CAS Name: (2E)-2-(2-azepanylidene)-2-(4-methoxyphenyl)acetonitrile IUPAC Name: (2E)-2-(azepan-2-ylidene)-2-(4-methoxyphenyl)acetonitrile Traditional Name: (2E)-2-(azepan-2-ylidene)-2-(4-methoxyphenyl)acetonitrile Formula: C15H18N2O MolecularWeight: 242.31622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=C2CCCCCN2)C#N

Isomeric SMILES

COC1=CC=C(C=C1)/C(=C\2/CCCCCN2)/C#N

InChI

InChI=1S/C15H18N2O/c1-18-13-8-6-12(7-9-13)14(11-16)15-5-3-2-4-10-17-15/h6-9,17H,2-5,10H2,1H3/b15-14-