3-(phenylmethyl)-3-(1,2,4-triazol-1-ylmethyl)-1-benzofuran-2-one

Systemtic Name: 3-(phenylmethyl)-3-(1,2,4-triazol-1-ylmethyl)-1-benzofuran-2-one Openeye Name: 3-benzyl-3-(1,2,4-triazol-1-ylmethyl)benzofuran-2-one CAS Name: 3-(phenylmethyl)-3-(1,2,4-triazol-1-ylmethyl)-2-benzofuranone IUPAC Name: 3-benzyl-3-(1,2,4-triazol-1-ylmethyl)-1-benzofuran-2-one Traditional Name: 3-benzyl-3-(1,2,4-triazol-1-ylmethyl)coumaran-2-one Formula: C18H15N3O2 MolecularWeight: 305.3306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2(C3=CC=CC=C3OC2=O)CN4C=NC=N4

Isomeric SMILES

C1=CC=C(C=C1)CC2(C3=CC=CC=C3OC2=O)CN4C=NC=N4

InChI

InChI=1S/C18H15N3O2/c22-17-18(11-21-13-19-12-20-21,10-14-6-2-1-3-7-14)15-8-4-5-9-16(15)23-17/h1-9,12-13H,10-11H2