methyl (2R,5E)-5-phenacylidene-1-(phenylmethyl)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R,5E)-5-phenacylidene-1-(phenylmethyl)pyrrolidine-2-carboxylate Openeye Name: methyl (2R,5E)-1-benzyl-5-phenacylidene-pyrrolidine-2-carboxylate CAS Name: (2R,5E)-5-phenacylidene-1-(phenylmethyl)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,5E)-1-benzyl-5-phenacylidenepyrrolidine-2-carboxylate Traditional Name: (2R,5E)-1-benzyl-5-phenacylidene-pyrrolidine-2-carboxylic acid methyl ester Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(=CC(=O)C2=CC=CC=C2)N1CC3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@H]1CC/C(=C\C(=O)C2=CC=CC=C2)/N1CC3=CC=CC=C3

InChI

InChI=1S/C21H21NO3/c1-25-21(24)19-13-12-18(14-20(23)17-10-6-3-7-11-17)22(19)15-16-8-4-2-5-9-16/h2-11,14,19H,12-13,15H2,1H3/b18-14+/t19-/m1/s1