1-(4-chlorophenyl)-3-nitro-3-phenyl-6-thiophen-2-yl-pyridine-2,4-dione

Systemtic Name: 1-(4-chlorophenyl)-3-nitro-3-phenyl-6-thiophen-2-yl-pyridine-2,4-dione Openeye Name: 1-(4-chlorophenyl)-3-nitro-3-phenyl-6-(2-thienyl)pyridine-2,4-dione CAS Name: 1-(4-chlorophenyl)-3-nitro-3-phenyl-6-thiophen-2-ylpyridine-2,4-dione IUPAC Name: 1-(4-chlorophenyl)-3-nitro-3-phenyl-6-thiophen-2-ylpyridine-2,4-dione Traditional Name: 1-(4-chlorophenyl)-3-nitro-3-phenyl-6-(2-thienyl)pyridine-2,4-quinone Formula: C21H13ClN2O4S MolecularWeight: 424.85692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H13ClN2O4S/c22-15-8-10-16(11-9-15)23-17(18-7-4-12-29-18)13-19(25)21(20(23)26,24(27)28)14-5-2-1-3-6-14/h1-13H