6-[1-(3-chlorophenyl)carbonyloxyethyl]phenazine-1-carboxylic acid

Systemtic Name: 6-[1-(3-chlorophenyl)carbonyloxyethyl]phenazine-1-carboxylic acid Openeye Name: 6-[1-(3-chlorobenzoyl)oxyethyl]phenazine-1-carboxylic acid CAS Name: 6-[1-[(3-chlorophenyl)-oxomethoxy]ethyl]-1-phenazinecarboxylic acid IUPAC Name: 6-[1-(3-chlorobenzoyl)oxyethyl]phenazine-1-carboxylic acid Traditional Name: 6-[1-(3-chlorobenzoyl)oxyethyl]phenazine-1-carboxylic acid Formula: C22H15ClN2O4 MolecularWeight: 406.8185

Click to see the large picture

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)Cl

Isomeric SMILES

CC(C1=CC=CC2=NC3=C(C=CC=C3N=C21)C(=O)O)OC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H15ClN2O4/c1-12(29-22(28)13-5-2-6-14(23)11-13)15-7-3-9-17-19(15)24-18-10-4-8-16(21(26)27)20(18)25-17/h2-12H,1H3,(H,26,27)