N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-[(2S)-2-(4-fluorophenyl)pyrrolidin-1-yl]ethanamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-[(2S)-2-(4-fluorophenyl)pyrrolidin-1-yl]ethanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(2S)-2-(4-fluorophenyl)pyrrolidin-1-yl]acetamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(2S)-2-(4-fluorophenyl)-1-pyrrolidinyl]acetamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(2S)-2-(4-fluorophenyl)pyrrolidin-1-yl]acetamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(2S)-2-(4-fluorophenyl)pyrrolidino]acetamide Formula: C21H21FN2O4 MolecularWeight: 384.400843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CN3CCCC3C4=CC=C(C=C4)F)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CN3CCC[C@H]3C4=CC=C(C=C4)F)OCO2

InChI

InChI=1S/C21H21FN2O4/c1-13(25)16-9-19-20(28-12-27-19)10-17(16)23-21(26)11-24-8-2-3-18(24)14-4-6-15(22)7-5-14/h4-7,9-10,18H,2-3,8,11-12H2,1H3,(H,23,26)/t18-/m0/s1