(2S)-1-(2-cyclopentyl-2-oxidanylidene-ethanoyl)azepane-2-carboxylic acid

Systemtic Name: (2S)-1-(2-cyclopentyl-2-oxidanylidene-ethanoyl)azepane-2-carboxylic acid Openeye Name: (2S)-1-(2-cyclopentyl-2-oxo-acetyl)azepane-2-carboxylic acid CAS Name: (2S)-1-(2-cyclopentyl-1,2-dioxoethyl)-2-azepanecarboxylic acid IUPAC Name: (2S)-1-(2-cyclopentyl-2-oxoacetyl)azepane-2-carboxylic acid Traditional Name: (2S)-1-(2-cyclopentyl-2-keto-acetyl)azepane-2-carboxylic acid Formula: C14H21NO4 MolecularWeight: 267.32084

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(N(CC1)C(=O)C(=O)C2CCCC2)C(=O)O

Isomeric SMILES

C1CC[C@H](N(CC1)C(=O)C(=O)C2CCCC2)C(=O)O

InChI

InChI=1S/C14H21NO4/c16-12(10-6-3-4-7-10)13(17)15-9-5-1-2-8-11(15)14(18)19/h10-11H,1-9H2,(H,18,19)/t11-/m0/s1