(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-pyrrolidin-1-ylpyridine-3-carboxylate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-pyrrolidin-1-ylpyridine-3-carboxylate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-pyrrolidin-1-ylpyridine-3-carboxylate CAS Name: 2-(1-pyrrolidinyl)-3-pyridinecarboxylic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-pyrrolidin-1-ylpyridine-3-carboxylate Traditional Name: 2-pyrrolidinonicotinic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C19H19ClN2O4 MolecularWeight: 374.81816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=N2)C(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=N2)C(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

InChI

InChI=1S/C19H19ClN2O4/c20-15-8-13-10-24-12-26-17(13)14(9-15)11-25-19(23)16-4-3-5-21-18(16)22-6-1-2-7-22/h3-5,8-9H,1-2,6-7,10-12H2