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

Systemtic Name: 5-[3-(4-hydroxyphenyl)propyl]-4-methyl-2-[(3-phenoxyphenyl)methyl]-1,2,4-triazol-3-one Openeye Name: 5-[3-(4-hydroxyphenyl)propyl]-4-methyl-2-[(3-phenoxyphenyl)methyl]-1,2,4-triazol-3-one CAS Name: 5-[3-(4-hydroxyphenyl)propyl]-4-methyl-2-[(3-phenoxyphenyl)methyl]-1,2,4-triazol-3-one IUPAC Name: 5-[3-(4-hydroxyphenyl)propyl]-4-methyl-2-[(3-phenoxyphenyl)methyl]-1,2,4-triazol-3-one Traditional Name: 5-[3-(4-hydroxyphenyl)propyl]-4-methyl-2-(3-phenoxybenzyl)-1,2,4-triazol-3-one Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=O)CC2=CC(=CC=C2)OC3=CC=CC=C3)CCCC4=CC=C(C=C4)O

Isomeric SMILES

CN1C(=NN(C1=O)CC2=CC(=CC=C2)OC3=CC=CC=C3)CCCC4=CC=C(C=C4)O

InChI

InChI=1S/C25H25N3O3/c1-27-24(12-6-7-19-13-15-21(29)16-14-19)26-28(25(27)30)18-20-8-5-11-23(17-20)31-22-9-3-2-4-10-22/h2-5,8-11,13-17,29H,6-7,12,18H2,1H3