2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]-N-(phenylcarbamoyl)ethanamide

Systemtic Name: 2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]-N-(phenylcarbamoyl)ethanamide Openeye Name: 2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]-N-(phenylcarbamoyl)acetamide CAS Name: N-[anilino(oxo)methyl]-2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: 2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]-N-(phenylcarbamoyl)acetamide Traditional Name: 2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]-N-(phenylcarbamoyl)acetamide Formula: C21H24N3O4+ MolecularWeight: 382.43296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC(=O)NC(=O)NC2=CC=CC=C2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC(=O)NC(=O)NC2=CC=CC=C2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H23N3O4/c25-20(23-21(26)22-16-5-2-1-3-6-16)14-24-10-4-7-17(24)15-8-9-18-19(13-15)28-12-11-27-18/h1-3,5-6,8-9,13,17H,4,7,10-12,14H2,(H2,22,23,25,26)/p+1/t17-/m1/s1