1-methyl-4-phenyl-azepane-4-carbonitrile

Systemtic Name: 1-methyl-4-phenyl-azepane-4-carbonitrile Openeye Name: 1-methyl-4-phenyl-azepane-4-carbonitrile CAS Name: 1-methyl-4-phenyl-4-azepanecarbonitrile IUPAC Name: 1-methyl-4-phenylazepane-4-carbonitrile Traditional Name: 1-methyl-4-phenyl-azepane-4-carbonitrile Formula: C14H18N2 MolecularWeight: 214.30612

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(CC1)(C#N)C2=CC=CC=C2

Isomeric SMILES

CN1CCCC(CC1)(C#N)C2=CC=CC=C2

InChI

InChI=1S/C14H18N2/c1-16-10-5-8-14(12-15,9-11-16)13-6-3-2-4-7-13/h2-4,6-7H,5,8-11H2,1H3