5-[4-[(1-adamantylcarbamoylamino)methyl]piperidin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[4-[(1-adamantylcarbamoylamino)methyl]piperidin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-[(1-adamantylcarbamoylamino)methyl]-1-piperidyl]-5-oxo-pentanoic acid CAS Name: 5-[4-[[[(1-adamantylamino)-oxomethyl]amino]methyl]-1-piperidinyl]-5-oxopentanoic acid IUPAC Name: 5-[4-[(1-adamantylcarbamoylamino)methyl]piperidin-1-yl]-5-oxopentanoic acid Traditional Name: 5-[4-[(1-adamantylcarbamoylamino)methyl]piperidino]-5-keto-valeric acid Formula: C22H35N3O4 MolecularWeight: 405.531

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)NC23CC4CC(C2)CC(C4)C3)C(=O)CCCC(=O)O

Isomeric SMILES

C1CN(CCC1CNC(=O)NC23CC4CC(C2)CC(C4)C3)C(=O)CCCC(=O)O

InChI

InChI=1S/C22H35N3O4/c26-19(2-1-3-20(27)28)25-6-4-15(5-7-25)14-23-21(29)24-22-11-16-8-17(12-22)10-18(9-16)13-22/h15-18H,1-14H2,(H,27,28)(H2,23,24,29)