3-[1-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)-3,6-dihydro-2H-pyridin-4-yl]-1H-pyrrolo[2,3-b]pyridine

Systemtic Name: 3-[1-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)-3,6-dihydro-2H-pyridin-4-yl]-1H-pyrrolo[2,3-b]pyridine Openeye Name: 3-[1-[2-nitro-4-(1-piperidylsulfonyl)phenyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-pyrrolo[2,3-b]pyridine CAS Name: 3-[1-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-pyrrolo[2,3-b]pyridine IUPAC Name: 3-[1-(2-nitro-4-piperidin-1-ylsulfonylphenyl)-3,6-dihydro-2H-pyridin-4-yl]-1H-pyrrolo[2,3-b]pyridine Traditional Name: 3-[1-(2-nitro-4-piperidinosulfonyl-phenyl)-3,6-dihydro-2H-pyridin-4-yl]-1H-pyrrolo[2,3-b]pyridine Formula: C23H25N5O4S MolecularWeight: 467.5407

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCC(=CC3)C4=CNC5=C4C=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCC(=CC3)C4=CNC5=C4C=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C23H25N5O4S/c29-28(30)22-15-18(33(31,32)27-11-2-1-3-12-27)6-7-21(22)26-13-8-17(9-14-26)20-16-25-23-19(20)5-4-10-24-23/h4-8,10,15-16H,1-3,9,11-14H2,(H,24,25)