dodecyl (2S)-2-azanyl-3-methyl-butanoate; (2S)-5-oxidanylidenepyrrolidine-2-carboxylic acid

Systemtic Name: dodecyl (2S)-2-azanyl-3-methyl-butanoate; (2S)-5-oxidanylidenepyrrolidine-2-carboxylic acid Openeye Name: dodecyl (2S)-2-amino-3-methyl-butanoate; (2S)-5-oxopyrrolidine-2-carboxylic acid CAS Name: (2S)-2-amino-3-methylbutanoic acid dodecyl ester; (2S)-5-oxo-2-pyrrolidinecarboxylic acid IUPAC Name: dodecyl (2S)-2-amino-3-methylbutanoate; (2S)-5-oxopyrrolidine-2-carboxylic acid Traditional Name: (2S)-2-amino-3-methyl-butyric acid lauryl ester; (2S)-5-ketoproline Formula: C22H42N2O5 MolecularWeight: 414.57928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(C(C)C)N.C1CC(=O)NC1C(=O)O

Isomeric SMILES

CCCCCCCCCCCCOC(=O)[C@H](C(C)C)N.C1CC(=O)N[C@@H]1C(=O)O

InChI

InChI=1S/C17H35NO2.C5H7NO3/c1-4-5-6-7-8-9-10-11-12-13-14-20-17(19)16(18)15(2)3;7-4-2-1-3(6-4)5(8)9/h15-16H,4-14,18H2,1-3H3;3H,1-2H2,(H,6,7)(H,8,9)/t16-;3-/m00/s1