1,3-benzodioxol-5-yl-[3-(2-ethoxyethoxy)-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[3-(2-ethoxyethoxy)-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[3-(2-ethoxyethoxy)-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[3-(2-ethoxyethoxy)-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[3-(2-ethoxyethoxy)-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[3-(2-ethoxyethoxy)-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]methanone Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2C(=O)C3=CC4=C(C=C3)OCO4)OCCOCC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2C(=O)C3=CC4=C(C=C3)OCO4)OCCOCC

InChI

InChI=1S/C22H23N3O5/c1-3-15-5-7-16(8-6-15)20-23-22(28-12-11-27-4-2)24-25(20)21(26)17-9-10-18-19(13-17)30-14-29-18/h5-10,13H,3-4,11-12,14H2,1-2H3