2-[(2-chlorophenyl)methyl]-5-(4-nitrophenoxy)isoindole-1,3-dione

Systemtic Name: 2-[(2-chlorophenyl)methyl]-5-(4-nitrophenoxy)isoindole-1,3-dione Openeye Name: 2-[(2-chlorophenyl)methyl]-5-(4-nitrophenoxy)isoindoline-1,3-dione CAS Name: 2-[(2-chlorophenyl)methyl]-5-(4-nitrophenoxy)isoindole-1,3-dione IUPAC Name: 2-[(2-chlorophenyl)methyl]-5-(4-nitrophenoxy)isoindole-1,3-dione Traditional Name: 2-(2-chlorobenzyl)-5-(4-nitrophenoxy)isoindoline-1,3-quinone Formula: C21H13ClN2O5 MolecularWeight: 408.79132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H13ClN2O5/c22-19-4-2-1-3-13(19)12-23-20(25)17-10-9-16(11-18(17)21(23)26)29-15-7-5-14(6-8-15)24(27)28/h1-11H,12H2