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

Systemtic Name: (2E)-2-(azepan-2-ylidene)-2-(4-chlorophenyl)ethanenitrile Openeye Name: (2E)-2-(azepan-2-ylidene)-2-(4-chlorophenyl)acetonitrile CAS Name: (2E)-2-(2-azepanylidene)-2-(4-chlorophenyl)acetonitrile IUPAC Name: (2E)-2-(azepan-2-ylidene)-2-(4-chlorophenyl)acetonitrile Traditional Name: (2E)-2-(azepan-2-ylidene)-2-(4-chlorophenyl)acetonitrile Formula: C14H15ClN2 MolecularWeight: 246.7353

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=C(C#N)C2=CC=C(C=C2)Cl)NCC1

Isomeric SMILES

C1CC/C(=C(\C#N)/C2=CC=C(C=C2)Cl)/NCC1

InChI

InChI=1S/C14H15ClN2/c15-12-7-5-11(6-8-12)13(10-16)14-4-2-1-3-9-17-14/h5-8,17H,1-4,9H2/b14-13-