1-(5-nitro-2-oxidanyl-phenyl)-3-(phenylmethyl)urea

Systemtic Name: 1-(5-nitro-2-oxidanyl-phenyl)-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-(2-hydroxy-5-nitro-phenyl)urea CAS Name: 1-(2-hydroxy-5-nitrophenyl)-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-(2-hydroxy-5-nitrophenyl)urea Traditional Name: 1-benzyl-3-(2-hydroxy-5-nitro-phenyl)urea Formula: C14H13N3O4 MolecularWeight: 287.27072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C14H13N3O4/c18-13-7-6-11(17(20)21)8-12(13)16-14(19)15-9-10-4-2-1-3-5-10/h1-8,18H,9H2,(H2,15,16,19)