1,3-benzodioxol-5-yl-[5-(3-methoxyphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[5-(3-methoxyphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[3-isobutoxy-5-(3-methoxyphenyl)-1,2,4-triazol-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[5-(3-methoxyphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[5-(3-methoxyphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[3-isobutoxy-5-(3-methoxyphenyl)-1,2,4-triazol-1-yl]methanone Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=NN(C(=N1)C2=CC(=CC=C2)OC)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)COC1=NN(C(=N1)C2=CC(=CC=C2)OC)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21N3O5/c1-13(2)11-27-21-22-19(14-5-4-6-16(9-14)26-3)24(23-21)20(25)15-7-8-17-18(10-15)29-12-28-17/h4-10,13H,11-12H2,1-3H3