(2S)-5-oxidanylidene-2-(pentylamino)-5-[4-(3-piperidin-4-ylpropyl)piperidin-1-yl]pentanoic acid

Systemtic Name: (2S)-5-oxidanylidene-2-(pentylamino)-5-[4-(3-piperidin-4-ylpropyl)piperidin-1-yl]pentanoic acid Openeye Name: (2S)-5-oxo-2-(pentylamino)-5-[4-[3-(4-piperidyl)propyl]-1-piperidyl]pentanoic acid CAS Name: (2S)-5-oxo-2-(pentylamino)-5-[4-[3-(4-piperidinyl)propyl]-1-piperidinyl]pentanoic acid IUPAC Name: (2S)-5-oxo-2-(pentylamino)-5-[4-(3-piperidin-4-ylpropyl)piperidin-1-yl]pentanoic acid Traditional Name: (2S)-2-(amylamino)-5-keto-5-[4-[3-(4-piperidyl)propyl]piperidino]valeric acid Formula: C23H43N3O3 MolecularWeight: 409.60582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(CCC(=O)N1CCC(CC1)CCCC2CCNCC2)C(=O)O

Isomeric SMILES

CCCCCN[C@@H](CCC(=O)N1CCC(CC1)CCCC2CCNCC2)C(=O)O

InChI

InChI=1S/C23H43N3O3/c1-2-3-4-14-25-21(23(28)29)8-9-22(27)26-17-12-20(13-18-26)7-5-6-19-10-15-24-16-11-19/h19-21,24-25H,2-18H2,1H3,(H,28,29)/t21-/m0/s1