2-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[[2-(4-methoxyphenyl)thiazol-4-yl]methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[[2-(4-methoxyphenyl)-4-thiazolyl]methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[[2-(4-methoxyphenyl)thiazol-4-yl]methyl]-5-nitro-isoindoline-1,3-quinone Formula: C19H13N3O5S MolecularWeight: 395.38862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H13N3O5S/c1-27-14-5-2-11(3-6-14)17-20-12(10-28-17)9-21-18(23)15-7-4-13(22(25)26)8-16(15)19(21)24/h2-8,10H,9H2,1H3