2-(2-methyl-4-oxidanyl-phenyl)-5-nitro-6-piperidin-1-yl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(2-methyl-4-oxidanyl-phenyl)-5-nitro-6-piperidin-1-yl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(4-hydroxy-2-methyl-phenyl)-5-nitro-6-(1-piperidyl)benzo[de]isoquinoline-1,3-dione CAS Name: 2-(4-hydroxy-2-methylphenyl)-5-nitro-6-(1-piperidinyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(4-hydroxy-2-methylphenyl)-5-nitro-6-piperidin-1-ylbenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(4-hydroxy-2-methyl-phenyl)-5-nitro-6-piperidino-benzo[de]isoquinoline-1,3-quinone Formula: C24H21N3O5 MolecularWeight: 431.44064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)O)N2C(=O)C3=CC=CC4=C3C(=CC(=C4N5CCCCC5)[N+](=O)[O-])C2=O

Isomeric SMILES

CC1=C(C=CC(=C1)O)N2C(=O)C3=CC=CC4=C3C(=CC(=C4N5CCCCC5)[N+](=O)[O-])C2=O

InChI

InChI=1S/C24H21N3O5/c1-14-12-15(28)8-9-19(14)26-23(29)17-7-5-6-16-21(17)18(24(26)30)13-20(27(31)32)22(16)25-10-3-2-4-11-25/h5-9,12-13,28H,2-4,10-11H2,1H3