(3S)-2-tert-butyl-3-[2-(2,4-dichlorophenyl)-1H-indol-3-yl]-3H-isoindol-1-one

Systemtic Name: (3S)-2-tert-butyl-3-[2-(2,4-dichlorophenyl)-1H-indol-3-yl]-3H-isoindol-1-one Openeye Name: (3S)-2-tert-butyl-3-[2-(2,4-dichlorophenyl)-1H-indol-3-yl]isoindolin-1-one CAS Name: (3S)-2-tert-butyl-3-[2-(2,4-dichlorophenyl)-1H-indol-3-yl]-3H-isoindol-1-one IUPAC Name: (3S)-2-tert-butyl-3-[2-(2,4-dichlorophenyl)-1H-indol-3-yl]-3H-isoindol-1-one Traditional Name: (3S)-2-tert-butyl-3-[2-(2,4-dichlorophenyl)-1H-indol-3-yl]isoindolin-1-one Formula: C26H22Cl2N2O MolecularWeight: 449.37168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(C2=CC=CC=C2C1=O)C3=C(NC4=CC=CC=C43)C5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

CC(C)(C)N1[C@@H](C2=CC=CC=C2C1=O)C3=C(NC4=CC=CC=C43)C5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C26H22Cl2N2O/c1-26(2,3)30-24(16-8-4-5-9-17(16)25(30)31)22-19-10-6-7-11-21(19)29-23(22)18-13-12-15(27)14-20(18)28/h4-14,24,29H,1-3H3/t24-/m0/s1