3-ethynyl-N-[[2,3,6-tris(chloranyl)phenyl]methyl]aniline

Systemtic Name: 3-ethynyl-N-[[2,3,6-tris(chloranyl)phenyl]methyl]aniline Openeye Name: 3-ethynyl-N-[(2,3,6-trichlorophenyl)methyl]aniline CAS Name: 3-ethynyl-N-[(2,3,6-trichlorophenyl)methyl]aniline IUPAC Name: 3-ethynyl-N-[(2,3,6-trichlorophenyl)methyl]aniline Traditional Name: (3-ethynylphenyl)-(2,3,6-trichlorobenzyl)amine Formula: C15H10Cl3N MolecularWeight: 310.6056

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NCC2=C(C=CC(=C2Cl)Cl)Cl

Isomeric SMILES

C#CC1=CC(=CC=C1)NCC2=C(C=CC(=C2Cl)Cl)Cl

InChI

InChI=1S/C15H10Cl3N/c1-2-10-4-3-5-11(8-10)19-9-12-13(16)6-7-14(17)15(12)18/h1,3-8,19H,9H2