3-(1,3-benzodioxol-5-yl)-1-[2-(4-chlorophenyl)pyrrolidin-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(4-chlorophenyl)pyrrolidin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(4-chlorophenyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(4-chlorophenyl)-1-pyrrolidinyl]-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(4-chlorophenyl)pyrrolidin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(4-chlorophenyl)pyrrolidino]propan-1-one Formula: C20H20ClNO3 MolecularWeight: 357.8307

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC(N(C1)C(=O)CCC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H20ClNO3/c21-16-7-5-15(6-8-16)17-2-1-11-22(17)20(23)10-4-14-3-9-18-19(12-14)25-13-24-18/h3,5-9,12,17H,1-2,4,10-11,13H2