5,6-dinitro-1-(phenylmethyl)indole-2,3-dione

Systemtic Name: 5,6-dinitro-1-(phenylmethyl)indole-2,3-dione Openeye Name: 1-benzyl-5,6-dinitro-indoline-2,3-dione CAS Name: 5,6-dinitro-1-(phenylmethyl)indole-2,3-dione IUPAC Name: 1-benzyl-5,6-dinitroindole-2,3-dione Traditional Name: 1-benzyl-5,6-dinitro-isatin Formula: C15H9N3O6 MolecularWeight: 327.24846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC(=C(C=C3C(=O)C2=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC(=C(C=C3C(=O)C2=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H9N3O6/c19-14-10-6-12(17(21)22)13(18(23)24)7-11(10)16(15(14)20)8-9-4-2-1-3-5-9/h1-7H,8H2