2,7,8-tris(oxidanyl)-10-(4-propan-2-ylphenyl)phenoxazin-10-ium-3-one

Systemtic Name: 2,7,8-tris(oxidanyl)-10-(4-propan-2-ylphenyl)phenoxazin-10-ium-3-one Openeye Name: 2,7,8-trihydroxy-10-(4-isopropylphenyl)phenoxazin-10-ium-3-one CAS Name: 2,7,8-trihydroxy-10-(4-propan-2-ylphenyl)-3-phenoxazin-10-iumone IUPAC Name: 2,7,8-trihydroxy-10-(4-propan-2-ylphenyl)phenoxazin-10-ium-3-one Traditional Name: 2,7,8-trihydroxy-10-p-cumenyl-phenoxazin-10-ium-3-one Formula: C21H18NO5+ MolecularWeight: 364.37132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)[N+]2=C3C=C(C(=O)C=C3OC4=CC(=C(C=C42)O)O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[N+]2=C3C=C(C(=O)C=C3OC4=CC(=C(C=C42)O)O)O

InChI

InChI=1S/C21H17NO5/c1-11(2)12-3-5-13(6-4-12)22-14-7-16(23)18(25)9-20(14)27-21-10-19(26)17(24)8-15(21)22/h3-11H,1-2H3,(H2,23,24,25,26)/p+1