3-ethynyl-N-[(4-pyrazol-1-ylphenyl)methyl]aniline

Systemtic Name: 3-ethynyl-N-[(4-pyrazol-1-ylphenyl)methyl]aniline Openeye Name: 3-ethynyl-N-[(4-pyrazol-1-ylphenyl)methyl]aniline CAS Name: 3-ethynyl-N-[[4-(1-pyrazolyl)phenyl]methyl]aniline IUPAC Name: 3-ethynyl-N-[(4-pyrazol-1-ylphenyl)methyl]aniline Traditional Name: (3-ethynylphenyl)-(4-pyrazol-1-ylbenzyl)amine Formula: C18H15N3 MolecularWeight: 273.3318

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

C#CC1=CC(=CC=C1)NCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C18H15N3/c1-2-15-5-3-6-17(13-15)19-14-16-7-9-18(10-8-16)21-12-4-11-20-21/h1,3-13,19H,14H2