5-(4-ethoxyphenyl)-2-phenyl-1H-1,2,4-triazol-3-one

Systemtic Name: 5-(4-ethoxyphenyl)-2-phenyl-1H-1,2,4-triazol-3-one Openeye Name: 5-(4-ethoxyphenyl)-2-phenyl-1H-1,2,4-triazol-3-one CAS Name: 5-(4-ethoxyphenyl)-2-phenyl-1H-1,2,4-triazol-3-one IUPAC Name: 5-(4-ethoxyphenyl)-2-phenyl-1H-1,2,4-triazol-3-one Traditional Name: 2-phenyl-5-p-phenetyl-1H-1,2,4-triazol-3-one Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=O)N(N2)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=O)N(N2)C3=CC=CC=C3

InChI

InChI=1S/C16H15N3O2/c1-2-21-14-10-8-12(9-11-14)15-17-16(20)19(18-15)13-6-4-3-5-7-13/h3-11H,2H2,1H3,(H,17,18,20)