3-ethynyl-N-[(2-phenyl-1,2,3-triazol-4-yl)methyl]aniline

Systemtic Name: 3-ethynyl-N-[(2-phenyl-1,2,3-triazol-4-yl)methyl]aniline Openeye Name: 3-ethynyl-N-[(2-phenyltriazol-4-yl)methyl]aniline CAS Name: 3-ethynyl-N-[(2-phenyl-4-triazolyl)methyl]aniline IUPAC Name: 3-ethynyl-N-[(2-phenyltriazol-4-yl)methyl]aniline Traditional Name: (3-ethynylphenyl)-[(2-phenyltriazol-4-yl)methyl]amine Formula: C17H14N4 MolecularWeight: 274.31986

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NCC2=NN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C#CC1=CC(=CC=C1)NCC2=NN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H14N4/c1-2-14-7-6-8-15(11-14)18-12-16-13-19-21(20-16)17-9-4-3-5-10-17/h1,3-11,13,18H,12H2