4-(4-chloranylphenoxy)-N-propan-2-yl-but-2-yn-1-amine hydrochloride

Systemtic Name: 4-(4-chloranylphenoxy)-N-propan-2-yl-but-2-yn-1-amine hydrochloride Openeye Name: 4-(4-chlorophenoxy)-N-isopropyl-but-2-yn-1-amine hydrochloride CAS Name: 4-(4-chlorophenoxy)-N-propan-2-yl-2-butyn-1-amine hydrochloride IUPAC Name: 4-(4-chlorophenoxy)-N-propan-2-ylbut-2-yn-1-amine hydrochloride Traditional Name: 4-(4-chlorophenoxy)but-2-ynyl-isopropyl-amine hydrochloride Formula: C13H17Cl2NO MolecularWeight: 274.18618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC#CCOC1=CC=C(C=C1)Cl.Cl

Isomeric SMILES

CC(C)NCC#CCOC1=CC=C(C=C1)Cl.Cl

InChI

InChI=1S/C13H16ClNO.ClH/c1-11(2)15-9-3-4-10-16-13-7-5-12(14)6-8-13;/h5-8,11,15H,9-10H2,1-2H3;1H