2-butyl-5-methoxy-6-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-butyl-5-methoxy-6-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-butyl-5-methoxy-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-butyl-5-methoxy-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-butyl-5-methoxy-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-butyl-5-methoxy-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC3=C2C(=CC(=C3[N+](=O)[O-])OC)C1=O

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC3=C2C(=CC(=C3[N+](=O)[O-])OC)C1=O

InChI

InChI=1S/C17H16N2O5/c1-3-4-8-18-16(20)11-7-5-6-10-14(11)12(17(18)21)9-13(24-2)15(10)19(22)23/h5-7,9H,3-4,8H2,1-2H3