N-(3H-1,2-benzodioxol-6-ylmethyl)-5-chloranyl-2-(pyridin-4-ylmethylamino)benzamide

Systemtic Name: N-(3H-1,2-benzodioxol-6-ylmethyl)-5-chloranyl-2-(pyridin-4-ylmethylamino)benzamide Openeye Name: N-(3H-1,2-benzodioxol-6-ylmethyl)-5-chloro-2-(4-pyridylmethylamino)benzamide CAS Name: N-(3H-1,2-benzodioxol-6-ylmethyl)-5-chloro-2-(pyridin-4-ylmethylamino)benzamide IUPAC Name: N-(3H-1,2-benzodioxol-6-ylmethyl)-5-chloro-2-(pyridin-4-ylmethylamino)benzamide Traditional Name: N-(3H-1,2-benzodioxol-6-ylmethyl)-5-chloro-2-(4-pyridylmethylamino)benzamide Formula: C21H18ClN3O3 MolecularWeight: 395.83892

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)CNC(=O)C3=C(C=CC(=C3)Cl)NCC4=CC=NC=C4)OO1

Isomeric SMILES

C1C2=C(C=C(C=C2)CNC(=O)C3=C(C=CC(=C3)Cl)NCC4=CC=NC=C4)OO1

InChI

InChI=1S/C21H18ClN3O3/c22-17-3-4-19(24-11-14-5-7-23-8-6-14)18(10-17)21(26)25-12-15-1-2-16-13-27-28-20(16)9-15/h1-10,24H,11-13H2,(H,25,26)