5-[(4-chlorophenyl)-[2-oxidanidyl-4,6-bis(oxidanylidene)-1H-pyrimidin-5-yl]methyl]-4,6-bis(oxidanylidene)-1H-pyrimidin-2-olate; pyridin-1-ium

Systemtic Name: 5-[(4-chlorophenyl)-[2-oxidanidyl-4,6-bis(oxidanylidene)-1H-pyrimidin-5-yl]methyl]-4,6-bis(oxidanylidene)-1H-pyrimidin-2-olate; pyridin-1-ium Openeye Name: 5-[(4-chlorophenyl)-(2-oxido-4,6-dioxo-1H-pyrimidin-5-yl)methyl]-4,6-dioxo-1H-pyrimidin-2-olate; pyridin-1-ium CAS Name: 5-[(4-chlorophenyl)-(2-oxido-4,6-dioxo-1H-pyrimidin-5-yl)methyl]-4,6-dioxo-1H-pyrimidin-2-olate; pyridin-1-ium IUPAC Name: 5-[(4-chlorophenyl)-(2-oxido-4,6-dioxo-1H-pyrimidin-5-yl)methyl]-4,6-dioxo-1H-pyrimidin-2-olate; pyridin-1-ium Traditional Name: 5-[(4-chlorophenyl)-(4,6-diketo-2-oxido-1H-pyrimidin-5-yl)methyl]-4,6-diketo-1H-pyrimidin-2-olate; pyridin-1-ium Formula: C25H21ClN6O6 MolecularWeight: 536.92384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C=C1.C1=CC=[NH+]C=C1.C1=CC(=CC=C1C(C2C(=O)NC(=NC2=O)[O-])C3C(=O)NC(=NC3=O)[O-])Cl

Isomeric SMILES

C1=CC=[NH+]C=C1.C1=CC=[NH+]C=C1.C1=CC(=CC=C1C(C2C(=O)NC(=NC2=O)[O-])C3C(=O)NC(=NC3=O)[O-])Cl

InChI

InChI=1S/C15H11ClN4O6.2C5H5N/c16-6-3-1-5(2-4-6)7(8-10(21)17-14(25)18-11(8)22)9-12(23)19-15(26)20-13(9)24;2*1-2-4-6-5-3-1/h1-4,7-9H,(H2,17,18,21,22,25)(H2,19,20,23,24,26);2*1-5H