2-(3-morpholin-4-ylpropyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(3-morpholin-4-ylpropyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(3-morpholinopropyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-[3-(4-morpholinyl)propyl]-5,8-dinitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(3-morpholin-4-ylpropyl)-5,8-dinitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(3-morpholinopropyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-quinone Formula: C19H18N4O7 MolecularWeight: 414.36882

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCCN2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O7/c24-18-15-10-13(22(26)27)8-12-9-14(23(28)29)11-16(17(12)15)19(25)21(18)3-1-2-20-4-6-30-7-5-20/h8-11H,1-7H2