1-(1,3-benzodioxol-4-yl)-3-(4-nitro-2-oxidanyl-phenyl)urea

Systemtic Name: 1-(1,3-benzodioxol-4-yl)-3-(4-nitro-2-oxidanyl-phenyl)urea Openeye Name: 1-(1,3-benzodioxol-4-yl)-3-(2-hydroxy-4-nitro-phenyl)urea CAS Name: 1-(1,3-benzodioxol-4-yl)-3-(2-hydroxy-4-nitrophenyl)urea IUPAC Name: 1-(1,3-benzodioxol-4-yl)-3-(2-hydroxy-4-nitrophenyl)urea Traditional Name: 1-(1,3-benzodioxol-4-yl)-3-(2-hydroxy-4-nitro-phenyl)urea Formula: C14H11N3O6 MolecularWeight: 317.25364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=CC=CC(=C2O1)NC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1OC2=CC=CC(=C2O1)NC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C14H11N3O6/c18-11-6-8(17(20)21)4-5-9(11)15-14(19)16-10-2-1-3-12-13(10)23-7-22-12/h1-6,18H,7H2,(H2,15,16,19)