2-[3-(2-chloranyl-5-methyl-phenyl)-6-(methoxymethyl)-4-oxidanylidene-5-phenyl-2H-1,3-oxazin-3-ium-3-yl]-2-methyl-propanoate

Systemtic Name: 2-[3-(2-chloranyl-5-methyl-phenyl)-6-(methoxymethyl)-4-oxidanylidene-5-phenyl-2H-1,3-oxazin-3-ium-3-yl]-2-methyl-propanoate Openeye Name: 2-[3-(2-chloro-5-methyl-phenyl)-6-(methoxymethyl)-4-oxo-5-phenyl-2H-1,3-oxazin-3-ium-3-yl]-2-methyl-propanoate CAS Name: 2-[3-(2-chloro-5-methylphenyl)-6-(methoxymethyl)-4-oxo-5-phenyl-2H-1,3-oxazin-3-ium-3-yl]-2-methylpropanoate IUPAC Name: 2-[3-(2-chloro-5-methylphenyl)-6-(methoxymethyl)-4-oxo-5-phenyl-2H-1,3-oxazin-3-ium-3-yl]-2-methylpropanoate Traditional Name: 2-[3-(2-chloro-5-methyl-phenyl)-4-keto-6-(methoxymethyl)-5-phenyl-2H-1,3-oxazin-3-ium-3-yl]-2-methyl-propionate Formula: C23H24ClNO5 MolecularWeight: 429.89336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)[N+]2(COC(=C(C2=O)C3=CC=CC=C3)COC)C(C)(C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)[N+]2(COC(=C(C2=O)C3=CC=CC=C3)COC)C(C)(C)C(=O)[O-]

InChI

InChI=1S/C23H24ClNO5/c1-15-10-11-17(24)18(12-15)25(23(2,3)22(27)28)14-30-19(13-29-4)20(21(25)26)16-8-6-5-7-9-16/h5-12H,13-14H2,1-4H3