CC(C)(C)OC(=O)C(CN)(CN)C(=O)OC(C)(C)C.O=C(O)CCC1CC(CCCC2CCN(CCC(=O)O)C(CCC(=O)O)C2)CCN1CCC(=O)O

Name: 4,4′-trimethylene dipiperidine bispropanoic acid bis-boc-1,3-diamino propane

IUPAC: 3-[4-[3-[1,2-bis(2-carboxyethyl)piperidin-4-yl]propyl]-1-(2-carboxyethyl)piperidin-2-yl]propanoic acid;ditert-butyl 2,2-bis(aminomethyl)propanedioate

SMILES: CC(C)(C)OC(=O)C(CN)(CN)C(=O)OC(C)(C)C.O=C(O)CCC1CC(CCCC2CCN(CCC(=O)O)C(CCC(=O)O)C2)CCN1CCC(=O)O

Canonical SMILES: CC(C)(C)OC(=O)C(CN)(CN)C(=O)OC(C)(C)C.C1CN(C(CC1CCCC2CCN(C(C2)CCC(=O)O)CCC(=O)O)CCC(=O)O)CCC(=O)O

Summenformel: C38H68N4O12

Molare Masse: 773.00

InChIKey: PQRBJSDKWFCAQA-UHFFFAOYSA-N

InChI:

InChI=1S/C25H42N2O8.C13H26N2O4/c28-22(29)6-4-20-16-18(8-12-26(20)14-10-24(32)33)2-1-3-19-9-13-27(15-11-25(34)35)21(17-19)5-7-23(30)31;1-11(2,3)18-9(16)13(7-14,8-15)10(17)19-12(4,5)6/h18-21H,1-17H2,(H,28,29)(H,30,31)(H,32,33)(H,34,35);7-8,14-15H2,1-6H3

PubChem CID: 131735492 →

Synonyme

PQRBJSDKWFCAQA-UHFFFAOYSA-N4,4'-trimethylene dipiperidine bispropanoic acid bis-boc-1,3-diamino propane

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