6-[1-(2-nitrophenyl)carbonyloxyethyl]phenazine-1-carboxylic acid

Systemtic Name: 6-[1-(2-nitrophenyl)carbonyloxyethyl]phenazine-1-carboxylic acid Openeye Name: 6-[1-(2-nitrobenzoyl)oxyethyl]phenazine-1-carboxylic acid CAS Name: 6-[1-[(2-nitrophenyl)-oxomethoxy]ethyl]-1-phenazinecarboxylic acid IUPAC Name: 6-[1-(2-nitrobenzoyl)oxyethyl]phenazine-1-carboxylic acid Traditional Name: 6-[1-(2-nitrobenzoyl)oxyethyl]phenazine-1-carboxylic acid Formula: C22H15N3O6 MolecularWeight: 417.371

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=NC3=C(C=CC=C3N=C21)C(=O)O)OC(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC2=NC3=C(C=CC=C3N=C21)C(=O)O)OC(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H15N3O6/c1-12(31-22(28)14-6-2-3-11-18(14)25(29)30)13-7-4-9-16-19(13)23-17-10-5-8-15(21(26)27)20(17)24-16/h2-12H,1H3,(H,26,27)