1-[2-(2-hydroxyethylamino)ethyl]-3-[(E)-(4-nitrophenyl)methylideneamino]urea

Systemtic Name: 1-[2-(2-hydroxyethylamino)ethyl]-3-[(E)-(4-nitrophenyl)methylideneamino]urea Openeye Name: 1-[2-(2-hydroxyethylamino)ethyl]-3-[(E)-(4-nitrophenyl)methyleneamino]urea CAS Name: 1-[2-(2-hydroxyethylamino)ethyl]-3-[(E)-(4-nitrophenyl)methylideneamino]urea IUPAC Name: 1-[2-(2-hydroxyethylamino)ethyl]-3-[(E)-(4-nitrophenyl)methylideneamino]urea Traditional Name: 1-[2-(2-hydroxyethylamino)ethyl]-3-[(E)-(4-nitrobenzylidene)amino]urea Formula: C12H17N5O4 MolecularWeight: 295.29448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NNC(=O)NCCNCCO)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C=N/NC(=O)NCCNCCO)[N+](=O)[O-]

InChI

InChI=1S/C12H17N5O4/c18-8-7-13-5-6-14-12(19)16-15-9-10-1-3-11(4-2-10)17(20)21/h1-4,9,13,18H,5-8H2,(H2,14,16,19)/b15-9+