[3-oxidanyl-2-(1,2,4-triazol-1-ylmethyl)-3H-1-benzofuran-2-yl]-phenyl-methanone

Systemtic Name: [3-oxidanyl-2-(1,2,4-triazol-1-ylmethyl)-3H-1-benzofuran-2-yl]-phenyl-methanone Openeye Name: [3-hydroxy-2-(1,2,4-triazol-1-ylmethyl)-3H-benzofuran-2-yl]-phenyl-methanone CAS Name: [3-hydroxy-2-(1,2,4-triazol-1-ylmethyl)-3H-benzofuran-2-yl]-phenylmethanone IUPAC Name: [3-hydroxy-2-(1,2,4-triazol-1-ylmethyl)-3H-1-benzofuran-2-yl]-phenylmethanone Traditional Name: [3-hydroxy-2-(1,2,4-triazol-1-ylmethyl)coumaran-2-yl]-phenyl-methanone Formula: C18H15N3O3 MolecularWeight: 321.33

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2(C(C3=CC=CC=C3O2)O)CN4C=NC=N4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2(C(C3=CC=CC=C3O2)O)CN4C=NC=N4

InChI

InChI=1S/C18H15N3O3/c22-16(13-6-2-1-3-7-13)18(10-21-12-19-11-20-21)17(23)14-8-4-5-9-15(14)24-18/h1-9,11-12,17,23H,10H2