ethyl (E)-3-[(2R,5R)-2-butyl-5-(3-phenylselanylpropyl)pyrrolidin-1-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[(2R,5R)-2-butyl-5-(3-phenylselanylpropyl)pyrrolidin-1-yl]prop-2-enoate Openeye Name: ethyl (E)-3-[(2R,5R)-2-butyl-5-(3-phenylselanylpropyl)pyrrolidin-1-yl]prop-2-enoate CAS Name: (E)-3-[(2R,5R)-2-butyl-5-[3-(phenylseleno)propyl]-1-pyrrolidinyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(2R,5R)-2-butyl-5-(3-phenylselanylpropyl)pyrrolidin-1-yl]prop-2-enoate Traditional Name: (E)-3-[(2R,5R)-2-butyl-5-[3-(phenylseleno)propyl]pyrrolidino]acrylic acid ethyl ester Formula: C22H33NO2Se MolecularWeight: 422.46292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(N1C=CC(=O)OCC)CCC[Se]C2=CC=CC=C2

Isomeric SMILES

CCCC[C@@H]1CC[C@@H](N1/C=C/C(=O)OCC)CCC[Se]C2=CC=CC=C2

InChI

InChI=1S/C22H33NO2Se/c1-3-5-10-19-14-15-20(23(19)17-16-22(24)25-4-2)11-9-18-26-21-12-7-6-8-13-21/h6-8,12-13,16-17,19-20H,3-5,9-11,14-15,18H2,1-2H3/b17-16+/t19-,20+/m1/s1