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

Systemtic Name: 2-[[2-[(4-chloranylphenoxy)methyl]-1,3-thiazol-4-yl]methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[[2-[(4-chlorophenoxy)methyl]thiazol-4-yl]methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[[2-[(4-chlorophenoxy)methyl]-4-thiazolyl]methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-4-yl]methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[[2-[(4-chlorophenoxy)methyl]thiazol-4-yl]methyl]-5-nitro-isoindoline-1,3-quinone Formula: C19H12ClN3O5S MolecularWeight: 429.83368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC2=NC(=CS2)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1OCC2=NC(=CS2)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H12ClN3O5S/c20-11-1-4-14(5-2-11)28-9-17-21-12(10-29-17)8-22-18(24)15-6-3-13(23(26)27)7-16(15)19(22)25/h1-7,10H,8-9H2