[(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 2-(3-ethanoylphenoxy)ethanoate

Systemtic Name: [(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 2-(3-ethanoylphenoxy)ethanoate Openeye Name: [(1R)-2-(1-adamantylamino)-1-methyl-2-oxo-ethyl] 2-(3-acetylphenoxy)acetate CAS Name: 2-(3-acetylphenoxy)acetic acid [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl] 2-(3-acetylphenoxy)acetate Traditional Name: 2-(3-acetylphenoxy)acetic acid [(1R)-2-(1-adamantylamino)-2-keto-1-methyl-ethyl] ester Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)COC4=CC=CC(=C4)C(=O)C

Isomeric SMILES

C[C@H](C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)COC4=CC=CC(=C4)C(=O)C

InChI

InChI=1S/C23H29NO5/c1-14(25)19-4-3-5-20(9-19)28-13-21(26)29-15(2)22(27)24-23-10-16-6-17(11-23)8-18(7-16)12-23/h3-5,9,15-18H,6-8,10-13H2,1-2H3,(H,24,27)/t15-,16?,17?,18?,23?/m1/s1