(4-chlorophenyl)methyl 2-(2-methyl-4-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (4-chlorophenyl)methyl 2-(2-methyl-4-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (4-chlorophenyl)methyl 2-(2-methyl-4-nitro-phenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2-methyl-4-nitrophenyl)-1,3-dioxo-5-isoindolecarboxylic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 2-(2-methyl-4-nitrophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(2-methyl-4-nitro-phenyl)isoindoline-5-carboxylic acid (4-chlorobenzyl) ester Formula: C23H15ClN2O6 MolecularWeight: 450.828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H15ClN2O6/c1-13-10-17(26(30)31)7-9-20(13)25-21(27)18-8-4-15(11-19(18)22(25)28)23(29)32-12-14-2-5-16(24)6-3-14/h2-11H,12H2,1H3