2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-6-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-6-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1CC(C2)N3C(=O)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=C5C3=O

Isomeric SMILES

CN1C2CCC1CC(C2)N3C(=O)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=C5C3=O

InChI

InChI=1S/C20H19N3O4/c1-21-11-5-6-12(21)10-13(9-11)22-19(24)15-4-2-3-14-17(23(26)27)8-7-16(18(14)15)20(22)25/h2-4,7-8,11-13H,5-6,9-10H2,1H3