5-chloranyl-1-ethyl-2,3,6,7-tetrahydroazepine-4-carbonitrile

Systemtic Name: 5-chloranyl-1-ethyl-2,3,6,7-tetrahydroazepine-4-carbonitrile Openeye Name: 5-chloro-1-ethyl-2,3,6,7-tetrahydroazepine-4-carbonitrile CAS Name: 5-chloro-1-ethyl-2,3,6,7-tetrahydroazepine-4-carbonitrile IUPAC Name: 5-chloro-1-ethyl-2,3,6,7-tetrahydroazepine-4-carbonitrile Traditional Name: 5-chloro-1-ethyl-2,3,6,7-tetrahydroazepine-4-carbonitrile Formula: C9H13ClN2 MolecularWeight: 184.66592

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(=C(CC1)Cl)C#N

Isomeric SMILES

CCN1CCC(=C(CC1)Cl)C#N

InChI

InChI=1S/C9H13ClN2/c1-2-12-5-3-8(7-11)9(10)4-6-12/h2-6H2,1H3