2-[(2S)-3-(2-ethylbenzimidazol-1-yl)-2-oxidanyl-propyl]isoindole-1,3-dione

Systemtic Name: 2-[(2S)-3-(2-ethylbenzimidazol-1-yl)-2-oxidanyl-propyl]isoindole-1,3-dione Openeye Name: 2-[(2S)-3-(2-ethylbenzimidazol-1-yl)-2-hydroxy-propyl]isoindoline-1,3-dione CAS Name: 2-[(2S)-3-(2-ethyl-1-benzimidazolyl)-2-hydroxypropyl]isoindole-1,3-dione IUPAC Name: 2-[(2S)-3-(2-ethylbenzimidazol-1-yl)-2-hydroxypropyl]isoindole-1,3-dione Traditional Name: 2-[(2S)-3-(2-ethylbenzimidazol-1-yl)-2-hydroxy-propyl]isoindoline-1,3-quinone Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2N1CC(CN3C(=O)C4=CC=CC=C4C3=O)O

Isomeric SMILES

CCC1=NC2=CC=CC=C2N1C[C@@H](CN3C(=O)C4=CC=CC=C4C3=O)O

InChI

InChI=1S/C20H19N3O3/c1-2-18-21-16-9-5-6-10-17(16)22(18)11-13(24)12-23-19(25)14-7-3-4-8-15(14)20(23)26/h3-10,13,24H,2,11-12H2,1H3/t13-/m0/s1