4-(5-azanylpent-1-ynyl)benzenecarbonitrile hydrochloride

Systemtic Name: 4-(5-azanylpent-1-ynyl)benzenecarbonitrile hydrochloride Openeye Name: 4-(5-aminopent-1-ynyl)benzonitrile hydrochloride CAS Name: 4-(5-aminopent-1-ynyl)benzonitrile hydrochloride IUPAC Name: 4-(5-aminopent-1-ynyl)benzonitrile hydrochloride Traditional Name: 4-(5-aminopent-1-ynyl)benzonitrile hydrochloride Formula: C12H13ClN2 MolecularWeight: 220.69802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CCCCN)C#N.Cl

Isomeric SMILES

C1=CC(=CC=C1C#CCCCN)C#N.Cl

InChI

InChI=1S/C12H12N2.ClH/c13-9-3-1-2-4-11-5-7-12(10-14)8-6-11;/h5-8H,1,3,9,13H2;1H