N-(1,3-benzodioxol-5-ylmethyl)-4-(4-phenoxypyrimidin-2-yl)benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-phenoxypyrimidin-2-yl)benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-phenoxypyrimidin-2-yl)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-phenoxy-2-pyrimidinyl)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-phenoxypyrimidin-2-yl)benzamide Traditional Name: 4-(4-phenoxypyrimidin-2-yl)-N-piperonyl-benzamide Formula: C25H19N3O4 MolecularWeight: 425.43606

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=C(C=C3)C4=NC=CC(=N4)OC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=C(C=C3)C4=NC=CC(=N4)OC5=CC=CC=C5

InChI

InChI=1S/C25H19N3O4/c29-25(27-15-17-6-11-21-22(14-17)31-16-30-21)19-9-7-18(8-10-19)24-26-13-12-23(28-24)32-20-4-2-1-3-5-20/h1-14H,15-16H2,(H,27,29)