7-tert-butyl-2-(4-nitrophenyl)-9H-pyrrolo[3,4-b][1,4]benzoxazine-1,3-dione

Systemtic Name: 7-tert-butyl-2-(4-nitrophenyl)-9H-pyrrolo[3,4-b][1,4]benzoxazine-1,3-dione Openeye Name: 7-tert-butyl-2-(4-nitrophenyl)-9H-pyrrolo[3,4-b][1,4]benzoxazine-1,3-dione CAS Name: 7-tert-butyl-2-(4-nitrophenyl)-9H-pyrrolo[3,4-b][1,4]benzoxazine-1,3-dione IUPAC Name: 7-tert-butyl-2-(4-nitrophenyl)-9H-pyrrolo[3,4-b][1,4]benzoxazine-1,3-dione Traditional Name: 7-tert-butyl-2-(4-nitrophenyl)-9H-pyrrolo[3,4-b][1,4]benzoxazine-1,3-quinone Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OC3=C(N2)C(=O)N(C3=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC3=C(N2)C(=O)N(C3=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O5/c1-20(2,3)11-4-9-15-14(10-11)21-16-17(28-15)19(25)22(18(16)24)12-5-7-13(8-6-12)23(26)27/h4-10,21H,1-3H3