N-[(3S)-3-ethyl-4,4-dimethyl-pent-1-yn-3-yl]-4-(trifluoromethyl)aniline

Systemtic Name: N-[(3S)-3-ethyl-4,4-dimethyl-pent-1-yn-3-yl]-4-(trifluoromethyl)aniline Openeye Name: N-[(1S)-1-tert-butyl-1-ethyl-prop-2-ynyl]-4-(trifluoromethyl)aniline CAS Name: N-[(3S)-3-ethyl-4,4-dimethylpent-1-yn-3-yl]-4-(trifluoromethyl)aniline IUPAC Name: N-[(3S)-3-ethyl-4,4-dimethylpent-1-yn-3-yl]-4-(trifluoromethyl)aniline Traditional Name: [(1S)-1-tert-butyl-1-ethyl-prop-2-ynyl]-[4-(trifluoromethyl)phenyl]amine Formula: C16H20F3N MolecularWeight: 283.33191

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#C)(C(C)(C)C)NC1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

CC[C@@](C#C)(C(C)(C)C)NC1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C16H20F3N/c1-6-15(7-2,14(3,4)5)20-13-10-8-12(9-11-13)16(17,18)19/h1,8-11,20H,7H2,2-5H3/t15-/m0/s1