2-(4-nitrophenoxy)-N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl]ethanamide

Systemtic Name: 2-(4-nitrophenoxy)-N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl]ethanamide Openeye Name: 2-(4-nitrophenoxy)-N-[(2S)-2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]acetamide CAS Name: 2-(4-nitrophenoxy)-N-[(2S)-2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]acetamide IUPAC Name: 2-(4-nitrophenoxy)-N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-ylethyl]acetamide Traditional Name: 2-(4-nitrophenoxy)-N-[(2S)-2-pyrrolidino-2-(2-thienyl)ethyl]acetamide Formula: C18H21N3O4S MolecularWeight: 375.44204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

C1CCN(C1)[C@@H](CNC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C18H21N3O4S/c22-18(13-25-15-7-5-14(6-8-15)21(23)24)19-12-16(17-4-3-11-26-17)20-9-1-2-10-20/h3-8,11,16H,1-2,9-10,12-13H2,(H,19,22)/t16-/m0/s1