4-chloranyl-N-(4-imidazol-1-ylbut-2-ynyl)benzamide

Systemtic Name: 4-chloranyl-N-(4-imidazol-1-ylbut-2-ynyl)benzamide Openeye Name: 4-chloro-N-(4-imidazol-1-ylbut-2-ynyl)benzamide CAS Name: 4-chloro-N-[4-(1-imidazolyl)but-2-ynyl]benzamide IUPAC Name: 4-chloro-N-(4-imidazol-1-ylbut-2-ynyl)benzamide Traditional Name: 4-chloro-N-(4-imidazol-1-ylbut-2-ynyl)benzamide Formula: C14H12ClN3O MolecularWeight: 273.71758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCC#CCN2C=CN=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCC#CCN2C=CN=C2)Cl

InChI

InChI=1S/C14H12ClN3O/c15-13-5-3-12(4-6-13)14(19)17-7-1-2-9-18-10-8-16-11-18/h3-6,8,10-11H,7,9H2,(H,17,19)