[3-(1,3-diphenylimidazolidin-2-yl)phenyl] 2,4-dinitrobenzoate

Systemtic Name: [3-(1,3-diphenylimidazolidin-2-yl)phenyl] 2,4-dinitrobenzoate Openeye Name: [3-(1,3-diphenylimidazolidin-2-yl)phenyl] 2,4-dinitrobenzoate CAS Name: 2,4-dinitrobenzoic acid [3-(1,3-diphenyl-2-imidazolidinyl)phenyl] ester IUPAC Name: [3-(1,3-diphenylimidazolidin-2-yl)phenyl] 2,4-dinitrobenzoate Traditional Name: 2,4-dinitrobenzoic acid [3-(1,3-diphenylimidazolidin-2-yl)phenyl] ester Formula: C28H22N4O6 MolecularWeight: 510.49748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N1C2=CC=CC=C2)C3=CC(=CC=C3)OC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

C1CN(C(N1C2=CC=CC=C2)C3=CC(=CC=C3)OC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C28H22N4O6/c33-28(25-15-14-23(31(34)35)19-26(25)32(36)37)38-24-13-7-8-20(18-24)27-29(21-9-3-1-4-10-21)16-17-30(27)22-11-5-2-6-12-22/h1-15,18-19,27H,16-17H2