3-chloranyl-3-methyl-but-1-yne; 4-chloranyl-N-(2-methylbut-3-yn-2-yl)aniline

Systemtic Name: 3-chloranyl-3-methyl-but-1-yne; 4-chloranyl-N-(2-methylbut-3-yn-2-yl)aniline Openeye Name: 4-chloro-N-(1,1-dimethylprop-2-ynyl)aniline; 3-chloro-3-methyl-but-1-yne CAS Name: 3-chloro-3-methyl-1-butyne; 4-chloro-N-(2-methylbut-3-yn-2-yl)aniline IUPAC Name: 3-chloro-3-methylbut-1-yne; 4-chloro-N-(2-methylbut-3-yn-2-yl)aniline Traditional Name: 3-chloro-3-methyl-but-1-yne; (4-chlorophenyl)-(1,1-dimethylprop-2-ynyl)amine Formula: C16H19Cl2N MolecularWeight: 296.23476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#C)NC1=CC=C(C=C1)Cl.CC(C)(C#C)Cl

Isomeric SMILES

CC(C)(C#C)NC1=CC=C(C=C1)Cl.CC(C)(C#C)Cl

InChI

InChI=1S/C11H12ClN.C5H7Cl/c1-4-11(2,3)13-10-7-5-9(12)6-8-10;1-4-5(2,3)6/h1,5-8,13H,2-3H3;1H,2-3H3