[(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 3-[(2-methoxyphenyl)carbonylamino]propanoate

Systemtic Name: [(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 3-[(2-methoxyphenyl)carbonylamino]propanoate Openeye Name: [(1R)-2-(1-adamantylamino)-1-methyl-2-oxo-ethyl] 3-[(2-methoxybenzoyl)amino]propanoate CAS Name: 3-[[(2-methoxyphenyl)-oxomethyl]amino]propanoic acid [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl] 3-[(2-methoxybenzoyl)amino]propanoate Traditional Name: 3-(o-anisoylamino)propionic acid [(1R)-2-(1-adamantylamino)-2-keto-1-methyl-ethyl] ester Formula: C24H32N2O5 MolecularWeight: 428.52128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)CCNC(=O)C4=CC=CC=C4OC

Isomeric SMILES

C[C@H](C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)CCNC(=O)C4=CC=CC=C4OC

InChI

InChI=1S/C24H32N2O5/c1-15(22(28)26-24-12-16-9-17(13-24)11-18(10-16)14-24)31-21(27)7-8-25-23(29)19-5-3-4-6-20(19)30-2/h3-6,15-18H,7-14H2,1-2H3,(H,25,29)(H,26,28)/t15-,16?,17?,18?,24?/m1/s1