(4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(3-nitrophenyl)-1,3-oxazol-5-one

Systemtic Name: (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(3-nitrophenyl)-1,3-oxazol-5-one Openeye Name: (4E)-4-(1,3-benzodioxol-5-ylmethylene)-2-(3-nitrophenyl)oxazol-5-one CAS Name: (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(3-nitrophenyl)-5-oxazolone IUPAC Name: (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(3-nitrophenyl)-1,3-oxazol-5-one Traditional Name: (4E)-2-(3-nitrophenyl)-4-piperonylidene-2-oxazolin-5-one Formula: C17H10N2O6 MolecularWeight: 338.2711

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/3\C(=O)OC(=N3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H10N2O6/c20-17-13(6-10-4-5-14-15(7-10)24-9-23-14)18-16(25-17)11-2-1-3-12(8-11)19(21)22/h1-8H,9H2/b13-6+