N-[(5-chloranyl-1-methyl-imidazol-2-yl)methyl]-3-ethynyl-aniline

Systemtic Name: N-[(5-chloranyl-1-methyl-imidazol-2-yl)methyl]-3-ethynyl-aniline Openeye Name: N-[(5-chloro-1-methyl-imidazol-2-yl)methyl]-3-ethynyl-aniline CAS Name: N-[(5-chloro-1-methyl-2-imidazolyl)methyl]-3-ethynylaniline IUPAC Name: N-[(5-chloro-1-methylimidazol-2-yl)methyl]-3-ethynylaniline Traditional Name: (5-chloro-1-methyl-imidazol-2-yl)methyl-(3-ethynylphenyl)amine Formula: C13H12ClN3 MolecularWeight: 245.70748

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1CNC2=CC=CC(=C2)C#C)Cl

Isomeric SMILES

CN1C(=CN=C1CNC2=CC=CC(=C2)C#C)Cl

InChI

InChI=1S/C13H12ClN3/c1-3-10-5-4-6-11(7-10)15-9-13-16-8-12(14)17(13)2/h1,4-8,15H,9H2,2H3