5-(4-nitrophenyl)carbonyl-2-(1,3-thiazol-2-yl)isoindole-1,3-dione

Systemtic Name: 5-(4-nitrophenyl)carbonyl-2-(1,3-thiazol-2-yl)isoindole-1,3-dione Openeye Name: 5-(4-nitrobenzoyl)-2-thiazol-2-yl-isoindoline-1,3-dione CAS Name: 5-[(4-nitrophenyl)-oxomethyl]-2-(2-thiazolyl)isoindole-1,3-dione IUPAC Name: 5-(4-nitrobenzoyl)-2-(1,3-thiazol-2-yl)isoindole-1,3-dione Traditional Name: 5-(4-nitrobenzoyl)-2-thiazol-2-yl-isoindoline-1,3-quinone Formula: C18H9N3O5S MolecularWeight: 379.34616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=NC=CS4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=NC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C18H9N3O5S/c22-15(10-1-4-12(5-2-10)21(25)26)11-3-6-13-14(9-11)17(24)20(16(13)23)18-19-7-8-27-18/h1-9H