N-[3-(3-pyridin-3-ylpropanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-(3-pyridin-3-ylpropanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-[3-(3-pyridyl)propanoylamino]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[[1-oxo-3-(3-pyridinyl)propyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-(3-pyridin-3-ylpropanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-[3-(3-pyridyl)propanoylamino]phenyl]-piperonylamide Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC(=CC=C3)NC(=O)CCC4=CN=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC(=CC=C3)NC(=O)CCC4=CN=CC=C4

InChI

InChI=1S/C22H19N3O4/c26-21(9-6-15-3-2-10-23-13-15)24-17-4-1-5-18(12-17)25-22(27)16-7-8-19-20(11-16)29-14-28-19/h1-5,7-8,10-13H,6,9,14H2,(H,24,26)(H,25,27)