4-methyl-3-[(3-phenoxyphenyl)methyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-methyl-3-[(3-phenoxyphenyl)methyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-methyl-3-[(3-phenoxyphenyl)methyl]-1H-1,2,4-triazol-5-one CAS Name: 4-methyl-3-[(3-phenoxyphenyl)methyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-methyl-3-[(3-phenoxyphenyl)methyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-methyl-3-(3-phenoxybenzyl)-1H-1,2,4-triazol-5-one Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=O)CC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CN1C(=NNC1=O)CC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C16H15N3O2/c1-19-15(17-18-16(19)20)11-12-6-5-9-14(10-12)21-13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,18,20)