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

Systemtic Name: (2S)-5-oxidanylidene-2-(pentanoylamino)-5-[4-(3-piperidin-4-ylpropyl)piperidin-1-yl]pentanoic acid Openeye Name: (2S)-5-oxo-2-(pentanoylamino)-5-[4-[3-(4-piperidyl)propyl]-1-piperidyl]pentanoic acid CAS Name: (2S)-5-oxo-2-(1-oxopentylamino)-5-[4-[3-(4-piperidinyl)propyl]-1-piperidinyl]pentanoic acid IUPAC Name: (2S)-5-oxo-2-(pentanoylamino)-5-[4-(3-piperidin-4-ylpropyl)piperidin-1-yl]pentanoic acid Traditional Name: (2S)-5-keto-5-[4-[3-(4-piperidyl)propyl]piperidino]-2-(valerylamino)valeric acid Formula: C23H41N3O4 MolecularWeight: 423.58934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(CCC(=O)N1CCC(CC1)CCCC2CCNCC2)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C23H41N3O4/c1-2-3-7-21(27)25-20(23(29)30)8-9-22(28)26-16-12-19(13-17-26)6-4-5-18-10-14-24-15-11-18/h18-20,24H,2-17H2,1H3,(H,25,27)(H,29,30)/t20-/m0/s1