(phenylmethyl) (1S,2S)-2-[(2S)-2-methanoylpyrrolidin-1-yl]carbonylcyclohexane-1-carboxylate

Systemtic Name: (phenylmethyl) (1S,2S)-2-[(2S)-2-methanoylpyrrolidin-1-yl]carbonylcyclohexane-1-carboxylate Openeye Name: benzyl (1S,2S)-2-[(2S)-2-formylpyrrolidine-1-carbonyl]cyclohexanecarboxylate CAS Name: (1S,2S)-2-[[(2S)-2-formyl-1-pyrrolidinyl]-oxomethyl]-1-cyclohexanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (1S,2S)-2-[(2S)-2-formylpyrrolidine-1-carbonyl]cyclohexane-1-carboxylate Traditional Name: (1S,2S)-2-[(2S)-2-formylpyrrolidine-1-carbonyl]cyclohexanecarboxylic acid benzyl ester Formula: C20H25NO4 MolecularWeight: 343.4168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)N2CCCC2C=O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CC[C@@H]([C@H](C1)C(=O)N2CCC[C@H]2C=O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H25NO4/c22-13-16-9-6-12-21(16)19(23)17-10-4-5-11-18(17)20(24)25-14-15-7-2-1-3-8-15/h1-3,7-8,13,16-18H,4-6,9-12,14H2/t16-,17-,18-/m0/s1