[azanyl-[(4-phenoxyphenyl)amino]methylidene]-[6-(2-methoxy-2-oxidanylidene-ethyl)-4-oxidanylidene-1H-pyrimidin-2-yl]azanium

Systemtic Name: [azanyl-[(4-phenoxyphenyl)amino]methylidene]-[6-(2-methoxy-2-oxidanylidene-ethyl)-4-oxidanylidene-1H-pyrimidin-2-yl]azanium Openeye Name: [amino-(4-phenoxyanilino)methylene]-[6-(2-methoxy-2-oxo-ethyl)-4-oxo-1H-pyrimidin-2-yl]ammonium CAS Name: [amino-(4-phenoxyanilino)methylidene]-[6-(2-methoxy-2-oxoethyl)-4-oxo-1H-pyrimidin-2-yl]ammonium IUPAC Name: [amino-(4-phenoxyanilino)methylidene]-[6-(2-methoxy-2-oxoethyl)-4-oxo-1H-pyrimidin-2-yl]azanium Traditional Name: [amino-(4-phenoxyanilino)methylene]-[4-keto-6-(2-keto-2-methoxy-ethyl)-1H-pyrimidin-2-yl]ammonium Formula: C20H20N5O4+ MolecularWeight: 394.4039

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)[NH+]=C(N)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)[NH+]=C(N)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C20H19N5O4/c1-28-18(27)12-14-11-17(26)24-20(23-14)25-19(21)22-13-7-9-16(10-8-13)29-15-5-3-2-4-6-15/h2-11H,12H2,1H3,(H4,21,22,23,24,25,26)/p+1