2-chloranyl-5-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methylamino]benzoate

Systemtic Name: 2-chloranyl-5-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methylamino]benzoate Openeye Name: 2-chloro-5-[(2,4,6-trioxohexahydropyrimidin-5-ylidene)methylamino]benzoate CAS Name: 2-chloro-5-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]benzoate IUPAC Name: 2-chloro-5-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]benzoate Traditional Name: 2-chloro-5-[(2,4,6-triketohexahydropyrimidin-5-ylidene)methylamino]benzoate Formula: C12H7ClN3O5- MolecularWeight: 308.65408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC=C2C(=O)NC(=O)NC2=O)C(=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1NC=C2C(=O)NC(=O)NC2=O)C(=O)[O-])Cl

InChI

InChI=1S/C12H8ClN3O5/c13-8-2-1-5(3-6(8)11(19)20)14-4-7-9(17)15-12(21)16-10(7)18/h1-4,14H,(H,19,20)(H2,15,16,17,18,21)/p-1