(2S)-1-[(2S)-2-(azetidin-3-ylcarbonylamino)-3-cyclohexyl-propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2S)-2-(azetidin-3-ylcarbonylamino)-3-cyclohexyl-propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2S)-2-(azetidine-3-carbonylamino)-3-cyclohexyl-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2S)-2-[[3-azetidinyl(oxo)methyl]amino]-3-cyclohexyl-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2S)-2-(azetidine-3-carbonylamino)-3-cyclohexylpropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2S)-2-(azetidine-3-carbonylamino)-3-cyclohexyl-propanoyl]proline Formula: C18H29N3O4 MolecularWeight: 351.44056

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)N2CCCC2C(=O)O)NC(=O)C3CNC3

Isomeric SMILES

C1CCC(CC1)C[C@@H](C(=O)N2CCC[C@H]2C(=O)O)NC(=O)C3CNC3

InChI

InChI=1S/C18H29N3O4/c22-16(13-10-19-11-13)20-14(9-12-5-2-1-3-6-12)17(23)21-8-4-7-15(21)18(24)25/h12-15,19H,1-11H2,(H,20,22)(H,24,25)/t14-,15-/m0/s1