N-[2-(2,3-dihydroindol-1-yl)-2-pyridin-3-yl-ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-(2,3-dihydroindol-1-yl)-2-pyridin-3-yl-ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-indolin-1-yl-2-(3-pyridyl)ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-(2,3-dihydroindol-1-yl)-2-(3-pyridinyl)ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-(2,3-dihydroindol-1-yl)-2-pyridin-3-ylethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-indolin-1-yl-2-(3-pyridyl)ethyl]-piperonylamide Formula: C23H21N3O3 MolecularWeight: 387.43114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C(CNC(=O)C3=CC4=C(C=C3)OCO4)C5=CN=CC=C5

Isomeric SMILES

C1CN(C2=CC=CC=C21)C(CNC(=O)C3=CC4=C(C=C3)OCO4)C5=CN=CC=C5

InChI

InChI=1S/C23H21N3O3/c27-23(17-7-8-21-22(12-17)29-15-28-21)25-14-20(18-5-3-10-24-13-18)26-11-9-16-4-1-2-6-19(16)26/h1-8,10,12-13,20H,9,11,14-15H2,(H,25,27)