2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl (2S)-2-(1-adamantylcarbonylamino)propanoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl (2S)-2-(1-adamantylcarbonylamino)propanoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl (2S)-2-(adamantane-1-carbonylamino)propanoate CAS Name: (2S)-2-[[1-adamantyl(oxo)methyl]amino]propanoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl (2S)-2-(adamantane-1-carbonylamino)propanoate Traditional Name: (2S)-2-(adamantane-1-carbonylamino)propionic acid 2-phthalimidoethyl ester Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCCN1C(=O)C2=CC=CC=C2C1=O)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[C@@H](C(=O)OCCN1C(=O)C2=CC=CC=C2C1=O)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H28N2O5/c1-14(25-23(30)24-11-15-8-16(12-24)10-17(9-15)13-24)22(29)31-7-6-26-20(27)18-4-2-3-5-19(18)21(26)28/h2-5,14-17H,6-13H2,1H3,(H,25,30)/t14-,15?,16?,17?,24?/m0/s1