4-(2,5-dimethylphenoxy)-N-methyl-but-2-yn-1-amine hydrochloride

Systemtic Name: 4-(2,5-dimethylphenoxy)-N-methyl-but-2-yn-1-amine hydrochloride Openeye Name: 4-(2,5-dimethylphenoxy)-N-methyl-but-2-yn-1-amine hydrochloride CAS Name: 4-(2,5-dimethylphenoxy)-N-methyl-2-butyn-1-amine hydrochloride IUPAC Name: 4-(2,5-dimethylphenoxy)-N-methylbut-2-yn-1-amine hydrochloride Traditional Name: 4-(2,5-dimethylphenoxy)but-2-ynyl-methyl-amine hydrochloride Formula: C13H18ClNO MolecularWeight: 239.74112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC#CCNC.Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC#CCNC.Cl

InChI

InChI=1S/C13H17NO.ClH/c1-11-6-7-12(2)13(10-11)15-9-5-4-8-14-3;/h6-7,10,14H,8-9H2,1-3H3;1H