2,4,5-trimethoxy-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 2,4,5-trimethoxy-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 2,4,5-trimethoxy-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 2,4,5-trimethoxy-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide IUPAC Name: 2,4,5-trimethoxy-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 2,4,5-trimethoxy-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]benzamide Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NCC2=CC=C(C=C2)CN3C=NC=N3)OC)OC

InChI

InChI=1S/C20H22N4O4/c1-26-17-9-19(28-3)18(27-2)8-16(17)20(25)22-10-14-4-6-15(7-5-14)11-24-13-21-12-23-24/h4-9,12-13H,10-11H2,1-3H3,(H,22,25)