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

Systemtic Name: 2-chloranyl-5-[[1-ethyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methylamino]benzoate Openeye Name: 2-chloro-5-[(1-ethyl-2,4,6-trioxo-hexahydropyrimidin-5-ylidene)methylamino]benzoate CAS Name: 2-chloro-5-[(1-ethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]benzoate IUPAC Name: 2-chloro-5-[(1-ethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]benzoate Traditional Name: 2-chloro-5-[(1-ethyl-2,4,6-triketo-hexahydropyrimidin-5-ylidene)methylamino]benzoate Formula: C14H11ClN3O5- MolecularWeight: 336.70724

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CNC2=CC(=C(C=C2)Cl)C(=O)[O-])C(=O)NC1=O

Isomeric SMILES

CCN1C(=O)C(=CNC2=CC(=C(C=C2)Cl)C(=O)[O-])C(=O)NC1=O

InChI

InChI=1S/C14H12ClN3O5/c1-2-18-12(20)9(11(19)17-14(18)23)6-16-7-3-4-10(15)8(5-7)13(21)22/h3-6,16H,2H2,1H3,(H,21,22)(H,17,19,23)/p-1