[1-(1-phenylethylcarbamoyl)-2-adamantyl] ethanoate

Systemtic Name: [1-(1-phenylethylcarbamoyl)-2-adamantyl] ethanoate Openeye Name: [1-(1-phenylethylcarbamoyl)-2-adamantyl] acetate CAS Name: acetic acid [1-[oxo-(1-phenylethylamino)methyl]-2-adamantyl] ester IUPAC Name: [1-(1-phenylethylcarbamoyl)-2-adamantyl] acetate Traditional Name: acetic acid [1-(1-phenylethylcarbamoyl)-2-adamantyl] ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C23CC4CC(C2)CC(C4)C3OC(=O)C

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C23CC4CC(C2)CC(C4)C3OC(=O)C

InChI

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