6-nitro-2-(4-phenyl-1,3-thiazol-2-yl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 6-nitro-2-(4-phenyl-1,3-thiazol-2-yl)benzo[de]isoquinoline-1,3-dione Openeye Name: 6-nitro-2-(4-phenylthiazol-2-yl)benzo[de]isoquinoline-1,3-dione CAS Name: 6-nitro-2-(4-phenyl-2-thiazolyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-nitro-2-(4-phenyl-1,3-thiazol-2-yl)benzo[de]isoquinoline-1,3-dione Traditional Name: 6-nitro-2-(4-phenylthiazol-2-yl)benzo[de]isoquinoline-1,3-quinone Formula: C21H11N3O4S MolecularWeight: 401.39474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=C5C3=O

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=C5C3=O

InChI

InChI=1S/C21H11N3O4S/c25-19-14-8-4-7-13-17(24(27)28)10-9-15(18(13)14)20(26)23(19)21-22-16(11-29-21)12-5-2-1-3-6-12/h1-11H