1-ethyl-4-phenyl-azepane-4-carbonitrile hydrochloride

Systemtic Name: 1-ethyl-4-phenyl-azepane-4-carbonitrile hydrochloride Openeye Name: 1-ethyl-4-phenyl-azepane-4-carbonitrile hydrochloride CAS Name: 1-ethyl-4-phenyl-4-azepanecarbonitrile hydrochloride IUPAC Name: 1-ethyl-4-phenylazepane-4-carbonitrile hydrochloride Traditional Name: 1-ethyl-4-phenyl-azepane-4-carbonitrile hydrochloride Formula: C15H21ClN2 MolecularWeight: 264.79364

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(CC1)(C#N)C2=CC=CC=C2.Cl

Isomeric SMILES

CCN1CCCC(CC1)(C#N)C2=CC=CC=C2.Cl

InChI

InChI=1S/C15H20N2.ClH/c1-2-17-11-6-9-15(13-16,10-12-17)14-7-4-3-5-8-14;/h3-5,7-8H,2,6,9-12H2,1H3;1H