(2S)-1-[5-(azepan-1-yl)-5-oxidanylidene-pentanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[5-(azepan-1-yl)-5-oxidanylidene-pentanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[5-(azepan-1-yl)-5-oxo-pentanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[5-(1-azepanyl)-1,5-dioxopentyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[5-(azepan-1-yl)-5-oxopentanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[5-(azepan-1-yl)-5-keto-pentanoyl]proline Formula: C16H26N2O4 MolecularWeight: 310.38864

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCCC(=O)N2CCCC2C(=O)O

Isomeric SMILES

C1CCCN(CC1)C(=O)CCCC(=O)N2CCC[C@H]2C(=O)O

InChI

InChI=1S/C16H26N2O4/c19-14(17-10-3-1-2-4-11-17)8-5-9-15(20)18-12-6-7-13(18)16(21)22/h13H,1-12H2,(H,21,22)/t13-/m0/s1