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

Systemtic Name: 5-nitro-2-[(2-phenyl-1,3-thiazol-4-yl)methyl]isoindole-1,3-dione Openeye Name: 5-nitro-2-[(2-phenylthiazol-4-yl)methyl]isoindoline-1,3-dione CAS Name: 5-nitro-2-[(2-phenyl-4-thiazolyl)methyl]isoindole-1,3-dione IUPAC Name: 5-nitro-2-[(2-phenyl-1,3-thiazol-4-yl)methyl]isoindole-1,3-dione Traditional Name: 5-nitro-2-[(2-phenylthiazol-4-yl)methyl]isoindoline-1,3-quinone Formula: C18H11N3O4S MolecularWeight: 365.36264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H11N3O4S/c22-17-14-7-6-13(21(24)25)8-15(14)18(23)20(17)9-12-10-26-16(19-12)11-4-2-1-3-5-11/h1-8,10H,9H2