[1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 2-phenylethanoate

Systemtic Name: [1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 2-phenylethanoate Openeye Name: [2-(1-adamantylamino)-1-methyl-2-oxo-ethyl] 2-phenylacetate CAS Name: 2-phenylacetic acid [1-(1-adamantylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1-adamantylamino)-1-oxopropan-2-yl] 2-phenylacetate Traditional Name: 2-phenylacetic acid [2-(1-adamantylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H27NO3/c1-14(25-19(23)10-15-5-3-2-4-6-15)20(24)22-21-11-16-7-17(12-21)9-18(8-16)13-21/h2-6,14,16-18H,7-13H2,1H3,(H,22,24)