1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-(1-azepanyl)-2-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(azepan-1-yl)-2-oxoethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(azepan-1-yl)-2-keto-ethyl]proline Formula: C13H22N2O3 MolecularWeight: 254.32538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2CCCC2C(=O)O

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2CCCC2C(=O)O

InChI

InChI=1S/C13H22N2O3/c16-12(14-7-3-1-2-4-8-14)10-15-9-5-6-11(15)13(17)18/h11H,1-10H2,(H,17,18)