(2-benzamido-2-oxidanylidene-ethyl) (2S)-2-(1-adamantylcarbonylamino)propanoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) (2S)-2-(1-adamantylcarbonylamino)propanoate Openeye Name: (2-benzamido-2-oxo-ethyl) (2S)-2-(adamantane-1-carbonylamino)propanoate CAS Name: (2S)-2-[[1-adamantyl(oxo)methyl]amino]propanoic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) (2S)-2-(adamantane-1-carbonylamino)propanoate Traditional Name: (2S)-2-(adamantane-1-carbonylamino)propionic acid (2-benzamido-2-keto-ethyl) ester Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC(=O)C1=CC=CC=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NC(=O)C1=CC=CC=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H28N2O5/c1-14(21(28)30-13-19(26)25-20(27)18-5-3-2-4-6-18)24-22(29)23-10-15-7-16(11-23)9-17(8-15)12-23/h2-6,14-17H,7-13H2,1H3,(H,24,29)(H,25,26,27)/t14-,15?,16?,17?,23?/m0/s1