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

Systemtic Name: 2-ethyl-1-[3-methoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]hexan-1-one Openeye Name: 2-ethyl-1-[3-methoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]hexan-1-one CAS Name: 2-ethyl-1-[3-methoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-1-hexanone IUPAC Name: 2-ethyl-1-[3-methoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]hexan-1-one Traditional Name: 2-ethyl-1-[3-methoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]hexan-1-one Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O3/c1-5-7-8-13(6-2)17(22)21-16(19-18(20-21)24-4)14-9-11-15(23-3)12-10-14/h9-13H,5-8H2,1-4H3