bis[4-chloranyl-2-(phenylmethyl)phenyl] 4-nitrobenzene-1,2-dicarboxylate

Systemtic Name: bis[4-chloranyl-2-(phenylmethyl)phenyl] 4-nitrobenzene-1,2-dicarboxylate Openeye Name: bis(2-benzyl-4-chloro-phenyl) 4-nitrobenzene-1,2-dicarboxylate CAS Name: 4-nitrobenzene-1,2-dicarboxylic acid bis[4-chloro-2-(phenylmethyl)phenyl] ester IUPAC Name: bis(2-benzyl-4-chlorophenyl) 4-nitrobenzene-1,2-dicarboxylate Traditional Name: 4-nitrobenzene-1,2-dicarboxylic acid bis(2-benzyl-4-chloro-phenyl) ester Formula: C34H23Cl2NO6 MolecularWeight: 612.45552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)OC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)OC4=C(C=C(C=C4)Cl)CC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)OC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)OC4=C(C=C(C=C4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C34H23Cl2NO6/c35-26-11-15-31(24(19-26)17-22-7-3-1-4-8-22)42-33(38)29-14-13-28(37(40)41)21-30(29)34(39)43-32-16-12-27(36)20-25(32)18-23-9-5-2-6-10-23/h1-16,19-21H,17-18H2