[3-butoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-1-yl]-phenyl-methanone

Systemtic Name: [3-butoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-1-yl]-phenyl-methanone Openeye Name: [3-butoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-1-yl]-phenyl-methanone CAS Name: [3-butoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-1-yl]-phenylmethanone IUPAC Name: [3-butoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-1-yl]-phenylmethanone Traditional Name: [3-butoxy-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-1-yl]-phenyl-methanone Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NN(C(=N1)C2=CC(=C(C(=C2)OC)OC)OC)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=NN(C(=N1)C2=CC(=C(C(=C2)OC)OC)OC)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H25N3O5/c1-5-6-12-30-22-23-20(25(24-22)21(26)15-10-8-7-9-11-15)16-13-17(27-2)19(29-4)18(14-16)28-3/h7-11,13-14H,5-6,12H2,1-4H3