1-[5-(4-ethylphenyl)-3-(2-methoxyethoxy)-1,2,4-triazol-1-yl]heptan-1-one

Systemtic Name: 1-[5-(4-ethylphenyl)-3-(2-methoxyethoxy)-1,2,4-triazol-1-yl]heptan-1-one Openeye Name: 1-[5-(4-ethylphenyl)-3-(2-methoxyethoxy)-1,2,4-triazol-1-yl]heptan-1-one CAS Name: 1-[5-(4-ethylphenyl)-3-(2-methoxyethoxy)-1,2,4-triazol-1-yl]-1-heptanone IUPAC Name: 1-[5-(4-ethylphenyl)-3-(2-methoxyethoxy)-1,2,4-triazol-1-yl]heptan-1-one Traditional Name: 1-[5-(4-ethylphenyl)-3-(2-methoxyethoxy)-1,2,4-triazol-1-yl]heptan-1-one Formula: C20H29N3O3 MolecularWeight: 359.46256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N1C(=NC(=N1)OCCOC)C2=CC=C(C=C2)CC

Isomeric SMILES

CCCCCCC(=O)N1C(=NC(=N1)OCCOC)C2=CC=C(C=C2)CC

InChI

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