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

Systemtic Name: methyl 5-[4-[(1-adamantylcarbamoylamino)methyl]piperidin-1-yl]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[4-[(1-adamantylcarbamoylamino)methyl]-1-piperidyl]-5-oxo-pentanoate CAS Name: 5-[4-[[[(1-adamantylamino)-oxomethyl]amino]methyl]-1-piperidinyl]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[4-[(1-adamantylcarbamoylamino)methyl]piperidin-1-yl]-5-oxopentanoate Traditional Name: 5-[4-[(1-adamantylcarbamoylamino)methyl]piperidino]-5-keto-valeric acid methyl ester Formula: C23H37N3O4 MolecularWeight: 419.55758

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)N1CCC(CC1)CNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC(=O)CCCC(=O)N1CCC(CC1)CNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H37N3O4/c1-30-21(28)4-2-3-20(27)26-7-5-16(6-8-26)15-24-22(29)25-23-12-17-9-18(13-23)11-19(10-17)14-23/h16-19H,2-15H2,1H3,(H2,24,25,29)