2-benzo[e][1]benzofuran-1-yl-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]ethanamide

Systemtic Name: 2-benzo[e][1]benzofuran-1-yl-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]ethanamide Openeye Name: 2-benzo[e]benzofuran-1-yl-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]acetamide CAS Name: 2-(1-benzo[e]benzofuranyl)-N-[(2R)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]acetamide IUPAC Name: 2-benzo[e][1]benzofuran-1-yl-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]acetamide Traditional Name: 2-benzo[e]benzofuran-1-yl-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]acetamide Formula: C24H25N2O2S+ MolecularWeight: 405.5325

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3)C5=CC=CS5

Isomeric SMILES

C1CC[NH+](C1)[C@H](CNC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3)C5=CC=CS5

InChI

InChI=1S/C24H24N2O2S/c27-23(25-15-20(22-8-5-13-29-22)26-11-3-4-12-26)14-18-16-28-21-10-9-17-6-1-2-7-19(17)24(18)21/h1-2,5-10,13,16,20H,3-4,11-12,14-15H2,(H,25,27)/p+1/t20-/m1/s1