methyl (4R,5S)-5-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-methyl-2-methylidene-4-oxidanyl-heptanoate

Systemtic Name: methyl (4R,5S)-5-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-methyl-2-methylidene-4-oxidanyl-heptanoate Openeye Name: methyl (4R,5S)-5-(1,3-dioxoisoindolin-2-yl)-4-hydroxy-6-methyl-2-methylene-heptanoate CAS Name: (4R,5S)-5-(1,3-dioxo-2-isoindolyl)-4-hydroxy-6-methyl-2-methyleneheptanoic acid methyl ester IUPAC Name: methyl (4R,5S)-5-(1,3-dioxoisoindol-2-yl)-4-hydroxy-6-methyl-2-methylideneheptanoate Traditional Name: 2-[(2R,3S)-2-hydroxy-4-methyl-3-phthalimido-pentyl]acrylic acid methyl ester Formula: C18H21NO5 MolecularWeight: 331.36304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(CC(=C)C(=O)OC)O)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)[C@@H]([C@@H](CC(=C)C(=O)OC)O)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C18H21NO5/c1-10(2)15(14(20)9-11(3)18(23)24-4)19-16(21)12-7-5-6-8-13(12)17(19)22/h5-8,10,14-15,20H,3,9H2,1-2,4H3/t14-,15+/m1/s1