2-[5-[5,6-bis(chloranyl)-2-piperidin-4-yl-benzimidazol-1-yl]pentyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[5-[5,6-bis(chloranyl)-2-piperidin-4-yl-benzimidazol-1-yl]pentyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[5-[5,6-dichloro-2-(4-piperidyl)benzimidazol-1-yl]pentyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[5-[5,6-dichloro-2-(4-piperidinyl)-1-benzimidazolyl]pentyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[5-(5,6-dichloro-2-piperidin-4-ylbenzimidazol-1-yl)pentyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[5-[5,6-dichloro-2-(4-piperidyl)benzimidazol-1-yl]pentyl]-4-nitro-isoindoline-1,3-quinone Formula: C25H25Cl2N5O4 MolecularWeight: 530.4031

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=NC3=CC(=C(C=C3N2CCCCCN4C(=O)C5=C(C4=O)C(=CC=C5)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1CNCCC1C2=NC3=CC(=C(C=C3N2CCCCCN4C(=O)C5=C(C4=O)C(=CC=C5)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C25H25Cl2N5O4/c26-17-13-19-21(14-18(17)27)30(23(29-19)15-7-9-28-10-8-15)11-2-1-3-12-31-24(33)16-5-4-6-20(32(35)36)22(16)25(31)34/h4-6,13-15,28H,1-3,7-12H2