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5-butyl-2-(4-phenylmethoxyphenyl)-1H-1,2,4-triazol-3-one

5-butyl-2-(4-phenylmethoxyphenyl)-1H-1,2,4-triazol-3-one

Systemtic Name:5-butyl-2-(4-phenylmethoxyphenyl)-1H-1,2,4-triazol-3-one
Openeye Name:2-(4-benzyloxyphenyl)-5-butyl-1H-1,2,4-triazol-3-one
CAS Name:5-butyl-2-(4-phenylmethoxyphenyl)-1H-1,2,4-triazol-3-one
IUPAC Name:5-butyl-2-(4-phenylmethoxyphenyl)-1H-1,2,4-triazol-3-one
Traditional Name:2-(4-benzoxyphenyl)-5-butyl-1H-1,2,4-triazol-3-one
Formula: C19H21N3O2
MolecularWeight: 323.38894
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=O)N(N1)C2=CC=C(C=C2)OCC3=CC=CC=C3


Isomeric SMILES

CCCCC1=NC(=O)N(N1)C2=CC=C(C=C2)OCC3=CC=CC=C3


InChI

InChI=1S/C19H21N3O2/c1-2-3-9-18-20-19(23)22(21-18)16-10-12-17(13-11-16)24-14-15-7-5-4-6-8-15/h4-8,10-13H,2-3,9,14H2,1H3,(H,20,21,23)


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