4-(3,5-dimethylphenoxy)-N-methyl-but-2-yn-1-amine hydrochloride

Systemtic Name: 4-(3,5-dimethylphenoxy)-N-methyl-but-2-yn-1-amine hydrochloride Openeye Name: 4-(3,5-dimethylphenoxy)-N-methyl-but-2-yn-1-amine hydrochloride CAS Name: 4-(3,5-dimethylphenoxy)-N-methyl-2-butyn-1-amine hydrochloride IUPAC Name: 4-(3,5-dimethylphenoxy)-N-methylbut-2-yn-1-amine hydrochloride Traditional Name: 4-(3,5-dimethylphenoxy)but-2-ynyl-methyl-amine hydrochloride Formula: C13H18ClNO MolecularWeight: 239.74112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO.ClH/c1-11-8-12(2)10-13(9-11)15-7-5-4-6-14-3;/h8-10,14H,6-7H2,1-3H3;1H