bis(oxidanidyl)-[4-(2-oxidanylidenepropyl)-2-phenyl-4H-pyrimidin-5-ylidene]azanium

Systemtic Name: bis(oxidanidyl)-[4-(2-oxidanylidenepropyl)-2-phenyl-4H-pyrimidin-5-ylidene]azanium Openeye Name: (4-acetonyl-2-phenyl-4H-pyrimidin-5-ylidene)-dioxido-ammonium CAS Name: dioxido-[4-(2-oxopropyl)-2-phenyl-4H-pyrimidin-5-ylidene]ammonium IUPAC Name: dioxido-[4-(2-oxopropyl)-2-phenyl-4H-pyrimidin-5-ylidene]azanium Traditional Name: (4-acetonyl-2-phenyl-4H-pyrimidin-5-ylidene)-dioxido-ammonium Formula: C13H12N3O3- MolecularWeight: 258.25268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1C(=[N+]([O-])[O-])C=NC(=N1)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C13H12N3O3/c1-9(17)7-11-12(16(18)19)8-14-13(15-11)10-5-3-2-4-6-10/h2-6,8,11H,7H2,1H3/q-1