methyl 3-(4-chloranyl-10-oxidanidyl-3-oxidanyl-7-oxidanylidene-phenoxazin-10-ium-2-yl)propanoate

Systemtic Name: methyl 3-(4-chloranyl-10-oxidanidyl-3-oxidanyl-7-oxidanylidene-phenoxazin-10-ium-2-yl)propanoate Openeye Name: methyl 3-(4-chloro-3-hydroxy-10-oxido-7-oxo-phenoxazin-10-ium-2-yl)propanoate CAS Name: 3-(4-chloro-3-hydroxy-10-oxido-7-oxo-2-phenoxazin-10-iumyl)propanoic acid methyl ester IUPAC Name: methyl 3-(4-chloro-3-hydroxy-10-oxido-7-oxophenoxazin-10-ium-2-yl)propanoate Traditional Name: 3-(4-chloro-3-hydroxy-7-keto-10-oxido-phenoxazin-10-ium-2-yl)propionic acid methyl ester Formula: C16H12ClNO6 MolecularWeight: 349.72258

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC2=C(C(=C1O)Cl)OC3=CC(=O)C=CC3=[N+]2[O-]

Isomeric SMILES

COC(=O)CCC1=CC2=C(C(=C1O)Cl)OC3=CC(=O)C=CC3=[N+]2[O-]

InChI

InChI=1S/C16H12ClNO6/c1-23-13(20)5-2-8-6-11-16(14(17)15(8)21)24-12-7-9(19)3-4-10(12)18(11)22/h3-4,6-7,21H,2,5H2,1H3