(phenylmethyl) (2S)-1-[(2R,3S)-2-azanyl-3-oxidanyl-butanoyl]-2-methanoyl-pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) (2S)-1-[(2R,3S)-2-azanyl-3-oxidanyl-butanoyl]-2-methanoyl-pyrrolidine-2-carboxylate Openeye Name: benzyl (2S)-1-[(2R,3S)-2-amino-3-hydroxy-butanoyl]-2-formyl-pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2R,3S)-2-amino-3-hydroxy-1-oxobutyl]-2-formyl-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-1-[(2R,3S)-2-amino-3-hydroxybutanoyl]-2-formylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2R,3S)-2-amino-3-hydroxy-butanoyl]-2-formyl-pyrrolidine-2-carboxylic acid benzyl ester Formula: C17H22N2O5 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)N1CCCC1(C=O)C(=O)OCC2=CC=CC=C2)N)O

Isomeric SMILES

C[C@@H]([C@H](C(=O)N1CCC[C@]1(C=O)C(=O)OCC2=CC=CC=C2)N)O

InChI

InChI=1S/C17H22N2O5/c1-12(21)14(18)15(22)19-9-5-8-17(19,11-20)16(23)24-10-13-6-3-2-4-7-13/h2-4,6-7,11-12,14,21H,5,8-10,18H2,1H3/t12-,14+,17-/m0/s1