ethyl 4-[2-[3-(1-adamantylcarbamoylamino)propanoyloxy]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[3-(1-adamantylcarbamoylamino)propanoyloxy]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[3-(1-adamantylcarbamoylamino)propanoyloxy]acetyl]amino]benzoate CAS Name: 4-[[2-[3-[[(1-adamantylamino)-oxomethyl]amino]-1-oxopropoxy]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[3-(1-adamantylcarbamoylamino)propanoyloxy]acetyl]amino]benzoate Traditional Name: 4-[[2-[3-(1-adamantylcarbamoylamino)propanoyloxy]acetyl]amino]benzoic acid ethyl ester Formula: C25H33N3O6 MolecularWeight: 471.54602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C25H33N3O6/c1-2-33-23(31)19-3-5-20(6-4-19)27-21(29)15-34-22(30)7-8-26-24(32)28-25-12-16-9-17(13-25)11-18(10-16)14-25/h3-6,16-18H,2,7-15H2,1H3,(H,27,29)(H2,26,28,32)