4-(azepan-1-yl)benzene-1,2-dicarbonitrile

Systemtic Name: 4-(azepan-1-yl)benzene-1,2-dicarbonitrile Openeye Name: 4-(azepan-1-yl)phthalonitrile CAS Name: 4-(1-azepanyl)benzene-1,2-dicarbonitrile IUPAC Name: 4-(azepan-1-yl)benzene-1,2-dicarbonitrile Traditional Name: 4-(azepan-1-yl)phthalonitrile Formula: C14H15N3 MolecularWeight: 225.289

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=C(C=C2)C#N)C#N

Isomeric SMILES

C1CCCN(CC1)C2=CC(=C(C=C2)C#N)C#N

InChI

InChI=1S/C14H15N3/c15-10-12-5-6-14(9-13(12)11-16)17-7-3-1-2-4-8-17/h5-6,9H,1-4,7-8H2