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

Systemtic Name: 2-ethyl-1-[5-(3-methoxyphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]hexan-1-one Openeye Name: 2-ethyl-1-[3-isopropoxy-5-(3-methoxyphenyl)-1,2,4-triazol-1-yl]hexan-1-one CAS Name: 2-ethyl-1-[5-(3-methoxyphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]-1-hexanone IUPAC Name: 2-ethyl-1-[5-(3-methoxyphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]hexan-1-one Traditional Name: 2-ethyl-1-[3-isopropoxy-5-(3-methoxyphenyl)-1,2,4-triazol-1-yl]hexan-1-one Formula: C20H29N3O3 MolecularWeight: 359.46256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O3/c1-6-8-10-15(7-2)19(24)23-18(21-20(22-23)26-14(3)4)16-11-9-12-17(13-16)25-5/h9,11-15H,6-8,10H2,1-5H3