1-(3-phenylprop-2-ynyl)azepane hydrochloride

Systemtic Name: 1-(3-phenylprop-2-ynyl)azepane hydrochloride Openeye Name: 1-(3-phenylprop-2-ynyl)azepane hydrochloride CAS Name: 1-(3-phenylprop-2-ynyl)azepane hydrochloride IUPAC Name: 1-(3-phenylprop-2-ynyl)azepane hydrochloride Traditional Name: 1-(3-phenylprop-2-ynyl)azepane hydrochloride Formula: C15H20ClN MolecularWeight: 249.779

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC#CC2=CC=CC=C2.Cl

Isomeric SMILES

C1CCCN(CC1)CC#CC2=CC=CC=C2.Cl

InChI

InChI=1S/C15H19N.ClH/c1-2-7-13-16(12-6-1)14-8-11-15-9-4-3-5-10-15;/h3-5,9-10H,1-2,6-7,12-14H2;1H