(phenylmethyl) (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-methyl-6-oxidanyl-heptanoate

Systemtic Name: (phenylmethyl) (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-methyl-6-oxidanyl-heptanoate Openeye Name: benzyl (2S)-2-(1,3-dioxoisoindolin-2-yl)-6-hydroxy-6-methyl-heptanoate CAS Name: (2S)-2-(1,3-dioxo-2-isoindolyl)-6-hydroxy-6-methylheptanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-(1,3-dioxoisoindol-2-yl)-6-hydroxy-6-methylheptanoate Traditional Name: (2S)-6-hydroxy-6-methyl-2-phthalimido-enanthic acid benzyl ester Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC(C(=O)OCC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C2=O)O

Isomeric SMILES

CC(C)(CCC[C@@H](C(=O)OCC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C2=O)O

InChI

InChI=1S/C23H25NO5/c1-23(2,28)14-8-13-19(22(27)29-15-16-9-4-3-5-10-16)24-20(25)17-11-6-7-12-18(17)21(24)26/h3-7,9-12,19,28H,8,13-15H2,1-2H3/t19-/m0/s1