[(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 2-(5-ethanoyl-2-methoxy-phenyl)ethanoate

Systemtic Name: [(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 2-(5-ethanoyl-2-methoxy-phenyl)ethanoate Openeye Name: [(1R)-2-(1-adamantylamino)-1-methyl-2-oxo-ethyl] 2-(5-acetyl-2-methoxy-phenyl)acetate CAS Name: 2-(5-acetyl-2-methoxyphenyl)acetic acid [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl] 2-(5-acetyl-2-methoxyphenyl)acetate Traditional Name: 2-(5-acetyl-2-methoxy-phenyl)acetic acid [(1R)-2-(1-adamantylamino)-2-keto-1-methyl-ethyl] ester Formula: C24H31NO5 MolecularWeight: 413.50664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)CC4=C(C=CC(=C4)C(=O)C)OC

InChI

InChI=1S/C24H31NO5/c1-14(26)19-4-5-21(29-3)20(9-19)10-22(27)30-15(2)23(28)25-24-11-16-6-17(12-24)8-18(7-16)13-24/h4-5,9,15-18H,6-8,10-13H2,1-3H3,(H,25,28)/t15-,16?,17?,18?,24?/m1/s1