2-ethyl-1-[3-(2-methoxyethoxy)-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]hexan-1-one

Systemtic Name: 2-ethyl-1-[3-(2-methoxyethoxy)-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]hexan-1-one Openeye Name: 2-ethyl-1-[3-(2-methoxyethoxy)-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]hexan-1-one CAS Name: 2-ethyl-1-[3-(2-methoxyethoxy)-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-1-hexanone IUPAC Name: 2-ethyl-1-[3-(2-methoxyethoxy)-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]hexan-1-one Traditional Name: 2-ethyl-1-[3-(2-methoxyethoxy)-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]hexan-1-one Formula: C20H29N3O4 MolecularWeight: 375.46196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1C(=NC(=N1)OCCOC)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCC(CC)C(=O)N1C(=NC(=N1)OCCOC)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H29N3O4/c1-5-7-8-15(6-2)19(24)23-18(16-9-11-17(26-4)12-10-16)21-20(22-23)27-14-13-25-3/h9-12,15H,5-8,13-14H2,1-4H3