2-(2-methylpropyl)-5-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(2-methylpropyl)-5-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-isobutyl-5-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(2-methylpropyl)-5-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(2-methylpropyl)-5-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-isobutyl-5-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C16H14N2O4 MolecularWeight: 298.29336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC3=CC(=CC(=C32)C1=O)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC3=CC(=CC(=C32)C1=O)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O4/c1-9(2)8-17-15(19)12-5-3-4-10-6-11(18(21)22)7-13(14(10)12)16(17)20/h3-7,9H,8H2,1-2H3