6-(1-octanoyloxyethyl)phenazine-1-carboxylic acid

Systemtic Name: 6-(1-octanoyloxyethyl)phenazine-1-carboxylic acid Openeye Name: 6-(1-octanoyloxyethyl)phenazine-1-carboxylic acid CAS Name: 6-[1-(1-oxooctoxy)ethyl]-1-phenazinecarboxylic acid IUPAC Name: 6-(1-octanoyloxyethyl)phenazine-1-carboxylic acid Traditional Name: 6-(1-caprylyloxyethyl)phenazine-1-carboxylic acid Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC(C)C1=CC=CC2=NC3=C(C=CC=C3N=C21)C(=O)O

Isomeric SMILES

CCCCCCCC(=O)OC(C)C1=CC=CC2=NC3=C(C=CC=C3N=C21)C(=O)O

InChI

InChI=1S/C23H26N2O4/c1-3-4-5-6-7-14-20(26)29-15(2)16-10-8-12-18-21(16)24-19-13-9-11-17(23(27)28)22(19)25-18/h8-13,15H,3-7,14H2,1-2H3,(H,27,28)