4-[[2,4,6-tris(oxidanylidene)-1-phenyl-1,3-diazinan-5-ylidene]methylamino]butanoic acid

Systemtic Name: 4-[[2,4,6-tris(oxidanylidene)-1-phenyl-1,3-diazinan-5-ylidene]methylamino]butanoic acid Openeye Name: 4-[(2,4,6-trioxo-1-phenyl-hexahydropyrimidin-5-ylidene)methylamino]butanoic acid CAS Name: 4-[(2,4,6-trioxo-1-phenyl-1,3-diazinan-5-ylidene)methylamino]butanoic acid IUPAC Name: 4-[(2,4,6-trioxo-1-phenyl-1,3-diazinan-5-ylidene)methylamino]butanoic acid Traditional Name: 4-[(2,4,6-triketo-1-phenyl-hexahydropyrimidin-5-ylidene)methylamino]butyric acid Formula: C15H15N3O5 MolecularWeight: 317.2967

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CNCCCC(=O)O)C(=O)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=CNCCCC(=O)O)C(=O)NC2=O

InChI

InChI=1S/C15H15N3O5/c19-12(20)7-4-8-16-9-11-13(21)17-15(23)18(14(11)22)10-5-2-1-3-6-10/h1-3,5-6,9,16H,4,7-8H2,(H,19,20)(H,17,21,23)