4-(benzotriazol-1-yl)-1-(4-chlorophenyl)but-2-yn-1-ol

Systemtic Name: 4-(benzotriazol-1-yl)-1-(4-chlorophenyl)but-2-yn-1-ol Openeye Name: 4-(benzotriazol-1-yl)-1-(4-chlorophenyl)but-2-yn-1-ol CAS Name: 4-(1-benzotriazolyl)-1-(4-chlorophenyl)-2-butyn-1-ol IUPAC Name: 4-(benzotriazol-1-yl)-1-(4-chlorophenyl)but-2-yn-1-ol Traditional Name: 4-(benzotriazol-1-yl)-1-(4-chlorophenyl)but-2-yn-1-ol Formula: C16H12ClN3O MolecularWeight: 297.73898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CC#CC(C3=CC=C(C=C3)Cl)O

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CC#CC(C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C16H12ClN3O/c17-13-9-7-12(8-10-13)16(21)6-3-11-20-15-5-2-1-4-14(15)18-19-20/h1-2,4-5,7-10,16,21H,11H2