1-[3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-3,3-dimethyl-butan-1-one

Systemtic Name: 1-[3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-3,3-dimethyl-butan-1-one Openeye Name: 1-[3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-3,3-dimethyl-butan-1-one CAS Name: 1-[3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-3,3-dimethyl-1-butanone IUPAC Name: 1-[3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-3,3-dimethylbutan-1-one Traditional Name: 1-[3-butoxy-5-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-3,3-dimethyl-butan-1-one Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)OC)C(=O)CC(C)(C)C

Isomeric SMILES

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)OC)C(=O)CC(C)(C)C

InChI

InChI=1S/C19H27N3O3/c1-6-7-12-25-18-20-17(14-8-10-15(24-5)11-9-14)22(21-18)16(23)13-19(2,3)4/h8-11H,6-7,12-13H2,1-5H3