1,3-bis[[(E)-(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]urea

Systemtic Name: 1,3-bis[[(E)-(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]amino]urea Openeye Name: 1,3-bis[[(E)-(3-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]amino]urea CAS Name: 1,3-bis[[(E)-(3-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]amino]urea IUPAC Name: 1,3-bis[[(E)-(3-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]amino]urea Traditional Name: 1,3-bis[[(E)-(4-keto-3-nitro-cyclohexa-2,5-dien-1-ylidene)methyl]amino]urea Formula: C15H12N6O7 MolecularWeight: 388.29178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CC1=CNNC(=O)NNC=C2C=CC(=O)C(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C\1=CC(=O)C(=C/C1=C/NNC(=O)NN/C=C\2/C=C(C(=O)C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H12N6O7/c22-13-3-1-9(5-11(13)20(25)26)7-16-18-15(24)19-17-8-10-2-4-14(23)12(6-10)21(27)28/h1-8,16-17H,(H2,18,19,24)/b9-7+,10-8+