8-[2-[3,4-bis(oxidanyl)phenyl]ethyl]-10H-phenoxazine-1-carboxylic acid

Systemtic Name: 8-[2-[3,4-bis(oxidanyl)phenyl]ethyl]-10H-phenoxazine-1-carboxylic acid Openeye Name: 8-[2-(3,4-dihydroxyphenyl)ethyl]-10H-phenoxazine-1-carboxylic acid CAS Name: 8-[2-(3,4-dihydroxyphenyl)ethyl]-10H-phenoxazine-1-carboxylic acid IUPAC Name: 8-[2-(3,4-dihydroxyphenyl)ethyl]-10H-phenoxazine-1-carboxylic acid Traditional Name: 8-[2-(3,4-dihydroxyphenyl)ethyl]-10H-phenoxazine-1-carboxylic acid Formula: C21H17NO5 MolecularWeight: 363.36338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)OC3=C(N2)C=C(C=C3)CCC4=CC(=C(C=C4)O)O)C(=O)O

Isomeric SMILES

C1=CC(=C2C(=C1)OC3=C(N2)C=C(C=C3)CCC4=CC(=C(C=C4)O)O)C(=O)O

InChI

InChI=1S/C21H17NO5/c23-16-8-6-13(11-17(16)24)5-4-12-7-9-18-15(10-12)22-20-14(21(25)26)2-1-3-19(20)27-18/h1-3,6-11,22-24H,4-5H2,(H,25,26)