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

Systemtic Name: 5,8-dinitro-2-(4-piperidin-1-ylsulfonylphenyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 5,8-dinitro-2-[4-(1-piperidylsulfonyl)phenyl]benzo[de]isoquinoline-1,3-dione CAS Name: 5,8-dinitro-2-[4-(1-piperidinylsulfonyl)phenyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 5,8-dinitro-2-(4-piperidin-1-ylsulfonylphenyl)benzo[de]isoquinoline-1,3-dione Traditional Name: 5,8-dinitro-2-(4-piperidinosulfonylphenyl)benzo[de]isoquinoline-1,3-quinone Formula: C23H18N4O8S MolecularWeight: 510.47602

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=CC(=CC5=CC(=CC(=C54)C3=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=CC(=CC5=CC(=CC(=C54)C3=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H18N4O8S/c28-22-19-12-16(26(30)31)10-14-11-17(27(32)33)13-20(21(14)19)23(29)25(22)15-4-6-18(7-5-15)36(34,35)24-8-2-1-3-9-24/h4-7,10-13H,1-3,8-9H2