O-[1-(2-nitrophenyl)-3-phenyl-propyl] pyrrolidine-1-carbothioate

Systemtic Name: O-[1-(2-nitrophenyl)-3-phenyl-propyl] pyrrolidine-1-carbothioate Openeye Name: O-[1-(2-nitrophenyl)-3-phenyl-propyl] pyrrolidine-1-carbothioate CAS Name: 1-pyrrolidinecarbothioic acid O-[1-(2-nitrophenyl)-3-phenylpropyl] ester IUPAC Name: O-[1-(2-nitrophenyl)-3-phenylpropyl] pyrrolidine-1-carbothioate Traditional Name: pyrrolidine-1-carbothioic acid O-[1-(2-nitrophenyl)-3-phenyl-propyl] ester Formula: C20H22N2O3S MolecularWeight: 370.46528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)OC(CCC2=CC=CC=C2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=S)OC(CCC2=CC=CC=C2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O3S/c23-22(24)18-11-5-4-10-17(18)19(13-12-16-8-2-1-3-9-16)25-20(26)21-14-6-7-15-21/h1-5,8-11,19H,6-7,12-15H2