[(2R)-1-[[(1S,2S)-2-methylcyclohexyl]amino]-1-oxidanylidene-propan-2-yl] (2R)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate

Systemtic Name: [(2R)-1-[[(1S,2S)-2-methylcyclohexyl]amino]-1-oxidanylidene-propan-2-yl] (2R)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: [(1R)-1-methyl-2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxo-ethyl] (2R)-2-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: (2R)-2-(1,3-dioxo-2-isoindolyl)propanoic acid [(2R)-1-[[(1S,2S)-2-methylcyclohexyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-[[(1S,2S)-2-methylcyclohexyl]amino]-1-oxopropan-2-yl] (2R)-2-(1,3-dioxoisoindol-2-yl)propanoate Traditional Name: (2R)-2-phthalimidopropionic acid [(1R)-2-keto-1-methyl-2-[[(1S,2S)-2-methylcyclohexyl]amino]ethyl] ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(C)OC(=O)C(C)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)[C@@H](C)OC(=O)[C@@H](C)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H26N2O5/c1-12-8-4-7-11-17(12)22-18(24)14(3)28-21(27)13(2)23-19(25)15-9-5-6-10-16(15)20(23)26/h5-6,9-10,12-14,17H,4,7-8,11H2,1-3H3,(H,22,24)/t12-,13+,14+,17-/m0/s1