[2-[3,5-bis(hydroxymethyl)-1,2,4-triazol-4-yl]-5-bromanyl-phenyl]-phenyl-methanone

Systemtic Name: [2-[3,5-bis(hydroxymethyl)-1,2,4-triazol-4-yl]-5-bromanyl-phenyl]-phenyl-methanone Openeye Name: [2-[3,5-bis(hydroxymethyl)-1,2,4-triazol-4-yl]-5-bromo-phenyl]-phenyl-methanone CAS Name: [2-[3,5-bis(hydroxymethyl)-1,2,4-triazol-4-yl]-5-bromophenyl]-phenylmethanone IUPAC Name: [2-[3,5-bis(hydroxymethyl)-1,2,4-triazol-4-yl]-5-bromophenyl]-phenylmethanone Traditional Name: [5-bromo-2-(3,5-dimethylol-1,2,4-triazol-4-yl)phenyl]-phenyl-methanone Formula: C17H14BrN3O3 MolecularWeight: 388.21536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)N3C(=NN=C3CO)CO

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)N3C(=NN=C3CO)CO

InChI

InChI=1S/C17H14BrN3O3/c18-12-6-7-14(21-15(9-22)19-20-16(21)10-23)13(8-12)17(24)11-4-2-1-3-5-11/h1-8,22-23H,9-10H2