methyl (2S)-4-bromanyl-2-[(1R)-1-methoxy-3-oxidanylidene-1H-isoindol-2-yl]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-4-bromanyl-2-[(1R)-1-methoxy-3-oxidanylidene-1H-isoindol-2-yl]-4-methyl-pentanoate Openeye Name: methyl (2S)-4-bromo-2-[(1R)-1-methoxy-3-oxo-isoindolin-2-yl]-4-methyl-pentanoate CAS Name: (2S)-4-bromo-2-[(1R)-1-methoxy-3-oxo-1H-isoindol-2-yl]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-4-bromo-2-[(1R)-1-methoxy-3-oxo-1H-isoindol-2-yl]-4-methylpentanoate Traditional Name: (2S)-4-bromo-2-[(3R)-1-keto-3-methoxy-isoindolin-2-yl]-4-methyl-valeric acid methyl ester Formula: C16H20BrNO4 MolecularWeight: 370.2383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C[C@@H](C(=O)OC)N1[C@@H](C2=CC=CC=C2C1=O)OC)Br

InChI

InChI=1S/C16H20BrNO4/c1-16(2,17)9-12(15(20)22-4)18-13(19)10-7-5-6-8-11(10)14(18)21-3/h5-8,12,14H,9H2,1-4H3/t12-,14+/m0/s1