2-(2,3-dimethylphenyl)-5-nitro-6-piperidin-1-yl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(2,3-dimethylphenyl)-5-nitro-6-piperidin-1-yl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(2,3-dimethylphenyl)-5-nitro-6-(1-piperidyl)benzo[de]isoquinoline-1,3-dione CAS Name: 2-(2,3-dimethylphenyl)-5-nitro-6-(1-piperidinyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(2,3-dimethylphenyl)-5-nitro-6-piperidin-1-ylbenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(2,3-dimethylphenyl)-5-nitro-6-piperidino-benzo[de]isoquinoline-1,3-quinone Formula: C25H23N3O4 MolecularWeight: 429.46782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O4/c1-15-8-6-11-20(16(15)2)27-24(29)18-10-7-9-17-22(18)19(25(27)30)14-21(28(31)32)23(17)26-12-4-3-5-13-26/h6-11,14H,3-5,12-13H2,1-2H3