3-oxidanylidene-2-piperidin-2-yl-5-piperidin-4-yl-2-piperidin-3-ylcarbonyl-pentanoic acid

Systemtic Name: 3-oxidanylidene-2-piperidin-2-yl-5-piperidin-4-yl-2-piperidin-3-ylcarbonyl-pentanoic acid Openeye Name: 3-oxo-2-(piperidine-3-carbonyl)-2-(2-piperidyl)-5-(4-piperidyl)pentanoic acid CAS Name: 3-oxo-2-[oxo(3-piperidinyl)methyl]-2-(2-piperidinyl)-5-(4-piperidinyl)pentanoic acid IUPAC Name: 3-oxo-2-(piperidine-3-carbonyl)-2-piperidin-2-yl-5-piperidin-4-ylpentanoic acid Traditional Name: 3-keto-2-nipecotoyl-2-(2-piperidyl)-5-(4-piperidyl)valeric acid Formula: C21H35N3O4 MolecularWeight: 393.5203

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(C1)C(C(=O)CCC2CCNCC2)(C(=O)C3CCCNC3)C(=O)O

Isomeric SMILES

C1CCNC(C1)C(C(=O)CCC2CCNCC2)(C(=O)C3CCCNC3)C(=O)O

InChI

InChI=1S/C21H35N3O4/c25-18(7-6-15-8-12-22-13-9-15)21(20(27)28,17-5-1-2-11-24-17)19(26)16-4-3-10-23-14-16/h15-17,22-24H,1-14H2,(H,27,28)