methyl (2S)-1-(1,3-diphenylprop-2-ynyl)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-1-(1,3-diphenylprop-2-ynyl)pyrrolidine-2-carboxylate Openeye Name: methyl (2S)-1-(1,3-diphenylprop-2-ynyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(1,3-diphenylprop-2-ynyl)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-(1,3-diphenylprop-2-ynyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(1,3-diphenylprop-2-ynyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C21H21NO2 MolecularWeight: 319.39694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(C#CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@@H]1CCCN1C(C#CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H21NO2/c1-24-21(23)20-13-8-16-22(20)19(18-11-6-3-7-12-18)15-14-17-9-4-2-5-10-17/h2-7,9-12,19-20H,8,13,16H2,1H3/t19?,20-/m0/s1