2-(3,3-dimethyl-2-oxidanylidene-butylidene)-5-[(2-nitrophenyl)methylidene]-1,3-thiazolidin-4-one

Systemtic Name: 2-(3,3-dimethyl-2-oxidanylidene-butylidene)-5-[(2-nitrophenyl)methylidene]-1,3-thiazolidin-4-one Openeye Name: 2-(3,3-dimethyl-2-oxo-butylidene)-5-[(2-nitrophenyl)methylene]thiazolidin-4-one CAS Name: 2-(3,3-dimethyl-2-oxobutylidene)-5-[(2-nitrophenyl)methylidene]-4-thiazolidinone IUPAC Name: 2-(3,3-dimethyl-2-oxobutylidene)-5-[(2-nitrophenyl)methylidene]-1,3-thiazolidin-4-one Traditional Name: 2-(2-keto-3,3-dimethyl-butylidene)-5-(2-nitrobenzylidene)thiazolidin-4-one Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C=C1NC(=O)C(=CC2=CC=CC=C2[N+](=O)[O-])S1

Isomeric SMILES

CC(C)(C)C(=O)C=C1NC(=O)C(=CC2=CC=CC=C2[N+](=O)[O-])S1

InChI

InChI=1S/C16H16N2O4S/c1-16(2,3)13(19)9-14-17-15(20)12(23-14)8-10-6-4-5-7-11(10)18(21)22/h4-9H,1-3H3,(H,17,20)