ethyl 4-[1-[4-(1-adamantylcarbamoylamino)butanoyloxy]ethyl]benzoate

Systemtic Name: ethyl 4-[1-[4-(1-adamantylcarbamoylamino)butanoyloxy]ethyl]benzoate Openeye Name: ethyl 4-[1-[4-(1-adamantylcarbamoylamino)butanoyloxy]ethyl]benzoate CAS Name: 4-[1-[4-[[(1-adamantylamino)-oxomethyl]amino]-1-oxobutoxy]ethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[1-[4-(1-adamantylcarbamoylamino)butanoyloxy]ethyl]benzoate Traditional Name: 4-[1-[4-(1-adamantylcarbamoylamino)butanoyloxy]ethyl]benzoic acid ethyl ester Formula: C26H36N2O5 MolecularWeight: 456.57444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C(C)OC(=O)CCCNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C(C)OC(=O)CCCNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C26H36N2O5/c1-3-32-24(30)22-8-6-21(7-9-22)17(2)33-23(29)5-4-10-27-25(31)28-26-14-18-11-19(15-26)13-20(12-18)16-26/h6-9,17-20H,3-5,10-16H2,1-2H3,(H2,27,28,31)