[2-(2,5-diethylphenyl)-2-oxidanylidene-ethyl] 2-[2-(1-adamantyl)ethanoylamino]ethanoate

Systemtic Name: [2-(2,5-diethylphenyl)-2-oxidanylidene-ethyl] 2-[2-(1-adamantyl)ethanoylamino]ethanoate Openeye Name: [2-(2,5-diethylphenyl)-2-oxo-ethyl] 2-[[2-(1-adamantyl)acetyl]amino]acetate CAS Name: 2-[[2-(1-adamantyl)-1-oxoethyl]amino]acetic acid [2-(2,5-diethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-diethylphenyl)-2-oxoethyl] 2-[[2-(1-adamantyl)acetyl]amino]acetate Traditional Name: 2-[[2-(1-adamantyl)acetyl]amino]acetic acid [2-(2,5-diethylphenyl)-2-keto-ethyl] ester Formula: C26H35NO4 MolecularWeight: 425.5604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC)C(=O)COC(=O)CNC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC1=CC(=C(C=C1)CC)C(=O)COC(=O)CNC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C26H35NO4/c1-3-17-5-6-21(4-2)22(10-17)23(28)16-31-25(30)15-27-24(29)14-26-11-18-7-19(12-26)9-20(8-18)13-26/h5-6,10,18-20H,3-4,7-9,11-16H2,1-2H3,(H,27,29)