ethyl 4-[4-[1-oxidanyl-6-(oxidanylamino)-6-oxidanylidene-hexyl]phenyl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[1-oxidanyl-6-(oxidanylamino)-6-oxidanylidene-hexyl]phenyl]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[1-hydroxy-6-(hydroxyamino)-6-oxo-hexyl]phenyl]piperidine-1-carboxylate CAS Name: 4-[4-[1-hydroxy-6-(hydroxyamino)-6-oxohexyl]phenyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[1-hydroxy-6-(hydroxyamino)-6-oxohexyl]phenyl]piperidine-1-carboxylate Traditional Name: 4-[4-[1-hydroxy-6-(hydroxyamino)-6-keto-hexyl]phenyl]piperidine-1-carboxylic acid ethyl ester Formula: C20H30N2O5 MolecularWeight: 378.4626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)C2=CC=C(C=C2)C(CCCCC(=O)NO)O

Isomeric SMILES

CCOC(=O)N1CCC(CC1)C2=CC=C(C=C2)C(CCCCC(=O)NO)O

InChI

InChI=1S/C20H30N2O5/c1-2-27-20(25)22-13-11-16(12-14-22)15-7-9-17(10-8-15)18(23)5-3-4-6-19(24)21-26/h7-10,16,18,23,26H,2-6,11-14H2,1H3,(H,21,24)