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

Systemtic Name: ethyl 4-[2-(1-adamantyl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(1-adamantyl)acetyl]amino]benzoate CAS Name: 4-[[2-(1-adamantyl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(1-adamantyl)acetyl]amino]benzoate Traditional Name: 4-[[2-(1-adamantyl)acetyl]amino]benzoic acid ethyl ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H27NO3/c1-2-25-20(24)17-3-5-18(6-4-17)22-19(23)13-21-10-14-7-15(11-21)9-16(8-14)12-21/h3-6,14-16H,2,7-13H2,1H3,(H,22,23)