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

Systemtic Name: 2-(3-methoxyphenyl)-5-nitro-6-piperidin-1-yl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(3-methoxyphenyl)-5-nitro-6-(1-piperidyl)benzo[de]isoquinoline-1,3-dione CAS Name: 2-(3-methoxyphenyl)-5-nitro-6-(1-piperidinyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(3-methoxyphenyl)-5-nitro-6-piperidin-1-ylbenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(3-methoxyphenyl)-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:

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC4=C3C(=CC(=C4N5CCCCC5)[N+](=O)[O-])C2=O

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC4=C3C(=CC(=C4N5CCCCC5)[N+](=O)[O-])C2=O

InChI

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