(2S)-1-[(2S,3S)-2-(azetidin-3-ylcarbonylamino)-3-methyl-pentanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2S,3S)-2-(azetidin-3-ylcarbonylamino)-3-methyl-pentanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2S,3S)-2-(azetidine-3-carbonylamino)-3-methyl-pentanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2S,3S)-2-[[3-azetidinyl(oxo)methyl]amino]-3-methyl-1-oxopentyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2S,3S)-2-(azetidine-3-carbonylamino)-3-methylpentanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2S,3S)-2-(azetidine-3-carbonylamino)-3-methyl-pentanoyl]proline Formula: C15H25N3O4 MolecularWeight: 311.3767

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCCC1C(=O)O)NC(=O)C2CNC2

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)C2CNC2

InChI

InChI=1S/C15H25N3O4/c1-3-9(2)12(17-13(19)10-7-16-8-10)14(20)18-6-4-5-11(18)15(21)22/h9-12,16H,3-8H2,1-2H3,(H,17,19)(H,21,22)/t9-,11-,12-/m0/s1