[[azanyl-[3-methyl-2,4-bis(oxidanylidene)-1-phenyl-pyrimidin-1-ium-5-ylidene]methyl]amino] benzoate

Systemtic Name: [[azanyl-[3-methyl-2,4-bis(oxidanylidene)-1-phenyl-pyrimidin-1-ium-5-ylidene]methyl]amino] benzoate Openeye Name: [[amino-(3-methyl-2,4-dioxo-1-phenyl-pyrimidin-1-ium-5-ylidene)methyl]amino] benzoate CAS Name: benzoic acid [[amino-(3-methyl-2,4-dioxo-1-phenyl-5-pyrimidin-1-iumylidene)methyl]amino] ester IUPAC Name: [[amino-(3-methyl-2,4-dioxo-1-phenylpyrimidin-1-ium-5-ylidene)methyl]amino] benzoate Traditional Name: benzoic acid [[amino-(2,4-diketo-3-methyl-1-phenyl-pyrimidin-1-ium-5-ylidene)methyl]amino] ester Formula: C19H17N4O4+ MolecularWeight: 365.36268

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N)NOC(=O)C2=CC=CC=C2)C=[N+](C1=O)C3=CC=CC=C3

Isomeric SMILES

CN1C(=O)C(=C(N)NOC(=O)C2=CC=CC=C2)C=[N+](C1=O)C3=CC=CC=C3

InChI

InChI=1S/C19H16N4O4/c1-22-17(24)15(12-23(19(22)26)14-10-6-3-7-11-14)16(20)21-27-18(25)13-8-4-2-5-9-13/h2-12H,1H3,(H2,20,21)/p+1