2-[1-(3,6-dinitrocarbazol-9-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-(3,6-dinitrocarbazol-9-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]isoindole-1,3-dione Openeye Name: 2-[1-benzyl-2-(3,6-dinitrocarbazol-9-yl)-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[1-(3,6-dinitro-9-carbazolyl)-1-oxo-3-phenylpropan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[1-(3,6-dinitrocarbazol-9-yl)-1-oxo-3-phenylpropan-2-yl]isoindole-1,3-dione Traditional Name: 2-[1-benzyl-2-(3,6-dinitrocarbazol-9-yl)-2-keto-ethyl]isoindoline-1,3-quinone Formula: C29H18N4O7 MolecularWeight: 534.47582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)N2C3=C(C=C(C=C3)[N+](=O)[O-])C4=C2C=CC(=C4)[N+](=O)[O-])N5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)N2C3=C(C=C(C=C3)[N+](=O)[O-])C4=C2C=CC(=C4)[N+](=O)[O-])N5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C29H18N4O7/c34-27-20-8-4-5-9-21(20)28(35)31(27)26(14-17-6-2-1-3-7-17)29(36)30-24-12-10-18(32(37)38)15-22(24)23-16-19(33(39)40)11-13-25(23)30/h1-13,15-16,26H,14H2