3-(1,3-benzodioxol-5-yl)-1-(2-thiophen-3-ylpyrrolidin-1-yl)propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-(2-thiophen-3-ylpyrrolidin-1-yl)propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(3-thienyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(3-thiophenyl)-1-pyrrolidinyl]-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-(2-thiophen-3-ylpyrrolidin-1-yl)propan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-[2-(3-thienyl)pyrrolidino]propan-1-one Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO3S/c20-18(19-8-1-2-15(19)14-7-9-23-11-14)6-4-13-3-5-16-17(10-13)22-12-21-16/h3,5,7,9-11,15H,1-2,4,6,8,12H2