cyclohexyl 4-[2-(1-adamantyl)ethanoylamino]benzoate

Systemtic Name: cyclohexyl 4-[2-(1-adamantyl)ethanoylamino]benzoate Openeye Name: cyclohexyl 4-[[2-(1-adamantyl)acetyl]amino]benzoate CAS Name: 4-[[2-(1-adamantyl)-1-oxoethyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[[2-(1-adamantyl)acetyl]amino]benzoate Traditional Name: 4-[[2-(1-adamantyl)acetyl]amino]benzoic acid cyclohexyl ester Formula: C25H33NO3 MolecularWeight: 395.53442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H33NO3/c27-23(16-25-13-17-10-18(14-25)12-19(11-17)15-25)26-21-8-6-20(7-9-21)24(28)29-22-4-2-1-3-5-22/h6-9,17-19,22H,1-5,10-16H2,(H,26,27)