2-butyl-5-nitro-benzo[de]isoquinoline-1,3-dione

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC3=CC(=CC(=C32)C1=O)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC3=CC(=CC(=C32)C1=O)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O4/c1-2-3-7-17-15(19)12-6-4-5-10-8-11(18(21)22)9-13(14(10)12)16(17)20/h4-6,8-9H,2-3,7H2,1H3