(phenylmethyl) (2S,5S)-2-butyl-5-(2-methoxy-2-oxidanylidene-ethyl)pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S,5S)-2-butyl-5-(2-methoxy-2-oxidanylidene-ethyl)pyrrolidine-1-carboxylate Openeye Name: benzyl (2S,5S)-2-butyl-5-(2-methoxy-2-oxo-ethyl)pyrrolidine-1-carboxylate CAS Name: (2S,5S)-2-butyl-5-(2-methoxy-2-oxoethyl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,5S)-2-butyl-5-(2-methoxy-2-oxoethyl)pyrrolidine-1-carboxylate Traditional Name: (2S,5S)-2-butyl-5-(2-keto-2-methoxy-ethyl)pyrrolidine-1-carboxylic acid benzyl ester Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(N1C(=O)OCC2=CC=CC=C2)CC(=O)OC

Isomeric SMILES

CCCC[C@H]1CC[C@H](N1C(=O)OCC2=CC=CC=C2)CC(=O)OC

InChI

InChI=1S/C19H27NO4/c1-3-4-10-16-11-12-17(13-18(21)23-2)20(16)19(22)24-14-15-8-6-5-7-9-15/h5-9,16-17H,3-4,10-14H2,1-2H3/t16-,17-/m0/s1