4-(1,3-benzodioxol-5-ylmethylidene)-2-(2-chloranyl-5-nitro-phenyl)-1,3-oxazol-5-one

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylidene)-2-(2-chloranyl-5-nitro-phenyl)-1,3-oxazol-5-one Openeye Name: 4-(1,3-benzodioxol-5-ylmethylene)-2-(2-chloro-5-nitro-phenyl)oxazol-5-one CAS Name: 4-(1,3-benzodioxol-5-ylmethylidene)-2-(2-chloro-5-nitrophenyl)-5-oxazolone IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylidene)-2-(2-chloro-5-nitrophenyl)-1,3-oxazol-5-one Traditional Name: 2-(2-chloro-5-nitro-phenyl)-4-piperonylidene-2-oxazolin-5-one Formula: C17H9ClN2O6 MolecularWeight: 372.71616

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C3C(=O)OC(=N3)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C=C3C(=O)OC(=N3)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H9ClN2O6/c18-12-3-2-10(20(22)23)7-11(12)16-19-13(17(21)26-16)5-9-1-4-14-15(6-9)25-8-24-14/h1-7H,8H2