8-[3-[3,4-bis(oxidanyl)phenyl]propyl]-10H-phenoxazine-1-carboxylic acid

Systemtic Name: 8-[3-[3,4-bis(oxidanyl)phenyl]propyl]-10H-phenoxazine-1-carboxylic acid Openeye Name: 8-[3-(3,4-dihydroxyphenyl)propyl]-10H-phenoxazine-1-carboxylic acid CAS Name: 8-[3-(3,4-dihydroxyphenyl)propyl]-10H-phenoxazine-1-carboxylic acid IUPAC Name: 8-[3-(3,4-dihydroxyphenyl)propyl]-10H-phenoxazine-1-carboxylic acid Traditional Name: 8-[3-(3,4-dihydroxyphenyl)propyl]-10H-phenoxazine-1-carboxylic acid Formula: C22H19NO5 MolecularWeight: 377.38996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)OC3=C(N2)C=C(C=C3)CCCC4=CC(=C(C=C4)O)O)C(=O)O

Isomeric SMILES

C1=CC(=C2C(=C1)OC3=C(N2)C=C(C=C3)CCCC4=CC(=C(C=C4)O)O)C(=O)O

InChI

InChI=1S/C22H19NO5/c24-17-9-7-14(12-18(17)25)4-1-3-13-8-10-19-16(11-13)23-21-15(22(26)27)5-2-6-20(21)28-19/h2,5-12,23-25H,1,3-4H2,(H,26,27)