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

Systemtic Name: 2-ethyl-1-[5-(4-methoxyphenyl)-3-propoxy-1,2,4-triazol-1-yl]hexan-1-one Openeye Name: 2-ethyl-1-[5-(4-methoxyphenyl)-3-propoxy-1,2,4-triazol-1-yl]hexan-1-one CAS Name: 2-ethyl-1-[5-(4-methoxyphenyl)-3-propoxy-1,2,4-triazol-1-yl]-1-hexanone IUPAC Name: 2-ethyl-1-[5-(4-methoxyphenyl)-3-propoxy-1,2,4-triazol-1-yl]hexan-1-one Traditional Name: 2-ethyl-1-[5-(4-methoxyphenyl)-3-propoxy-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)OCCC)C2=CC=C(C=C2)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O3/c1-5-8-9-15(7-3)19(24)23-18(21-20(22-23)26-14-6-2)16-10-12-17(25-4)13-11-16/h10-13,15H,5-9,14H2,1-4H3