tert-butyl N-[(4R)-4-(7-bromanyl-3-oxidanylidene-1H-isoindol-2-yl)-4-(3,4-dimethoxyphenyl)butyl]carbamate

Systemtic Name: tert-butyl N-[(4R)-4-(7-bromanyl-3-oxidanylidene-1H-isoindol-2-yl)-4-(3,4-dimethoxyphenyl)butyl]carbamate Openeye Name: tert-butyl N-[(4R)-4-(4-bromo-1-oxo-isoindolin-2-yl)-4-(3,4-dimethoxyphenyl)butyl]carbamate CAS Name: N-[(4R)-4-(7-bromo-3-oxo-1H-isoindol-2-yl)-4-(3,4-dimethoxyphenyl)butyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(4R)-4-(7-bromo-3-oxo-1H-isoindol-2-yl)-4-(3,4-dimethoxyphenyl)butyl]carbamate Traditional Name: N-[(4R)-4-(4-bromo-1-keto-isoindolin-2-yl)-4-(3,4-dimethoxyphenyl)butyl]carbamic acid tert-butyl ester Formula: C25H31BrN2O5 MolecularWeight: 519.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCC(C1=CC(=C(C=C1)OC)OC)N2CC3=C(C2=O)C=CC=C3Br

Isomeric SMILES

CC(C)(C)OC(=O)NCCC[C@H](C1=CC(=C(C=C1)OC)OC)N2CC3=C(C2=O)C=CC=C3Br

InChI

InChI=1S/C25H31BrN2O5/c1-25(2,3)33-24(30)27-13-7-10-20(16-11-12-21(31-4)22(14-16)32-5)28-15-18-17(23(28)29)8-6-9-19(18)26/h6,8-9,11-12,14,20H,7,10,13,15H2,1-5H3,(H,27,30)/t20-/m1/s1