(6-iodanyl-2-phenyl-quinolin-4-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (6-iodanyl-2-phenyl-quinolin-4-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (6-iodo-2-phenyl-4-quinolyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (6-iodo-2-phenyl-4-quinolinyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (6-iodo-2-phenylquinolin-4-yl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (6-iodo-2-phenyl-4-quinolyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C26H21IN4O3 MolecularWeight: 564.37441

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=NC4=C3C=C(C=C4)I)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=NC4=C3C=C(C=C4)I)C5=CC=CC=C5

InChI

InChI=1S/C26H21IN4O3/c27-19-6-11-24-22(16-19)23(17-25(28-24)18-4-2-1-3-5-18)26(32)30-14-12-29(13-15-30)20-7-9-21(10-8-20)31(33)34/h1-11,16-17H,12-15H2