(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 2-(2-oxo-1-pyrrolidinyl)benzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 2-(2-ketopyrrolidino)benzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C20H18ClNO5 MolecularWeight: 387.81362

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=CC=C2C(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=CC=C2C(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

InChI

InChI=1S/C20H18ClNO5/c21-15-8-13-10-25-12-27-19(13)14(9-15)11-26-20(24)16-4-1-2-5-17(16)22-7-3-6-18(22)23/h1-2,4-5,8-9H,3,6-7,10-12H2