2-(4-azanylbutyl)-5-methoxy-3,6-bis(oxidanylidene)-1-(phenylcarbonyl)piperidine-2-carboxylic acid

Systemtic Name: 2-(4-azanylbutyl)-5-methoxy-3,6-bis(oxidanylidene)-1-(phenylcarbonyl)piperidine-2-carboxylic acid Openeye Name: 2-(4-aminobutyl)-1-benzoyl-5-methoxy-3,6-dioxo-piperidine-2-carboxylic acid CAS Name: 2-(4-aminobutyl)-1-benzoyl-5-methoxy-3,6-dioxo-2-piperidinecarboxylic acid IUPAC Name: 2-(4-aminobutyl)-1-benzoyl-5-methoxy-3,6-dioxopiperidine-2-carboxylic acid Traditional Name: 2-(4-aminobutyl)-1-benzoyl-3,6-diketo-5-methoxy-pipecolinic acid Formula: C18H22N2O6 MolecularWeight: 362.37708

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(=O)C(N(C1=O)C(=O)C2=CC=CC=C2)(CCCCN)C(=O)O

Isomeric SMILES

COC1CC(=O)C(N(C1=O)C(=O)C2=CC=CC=C2)(CCCCN)C(=O)O

InChI

InChI=1S/C18H22N2O6/c1-26-13-11-14(21)18(17(24)25,9-5-6-10-19)20(16(13)23)15(22)12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-11,19H2,1H3,(H,24,25)