5-cyano-N-[2-(cyclohexen-1-yl)-4-[1-(1-oxidanidylpyridin-1-ium-4-yl)carbonylpiperidin-4-yl]phenyl]-1H-imidazole-2-carboxamide

Systemtic Name: 5-cyano-N-[2-(cyclohexen-1-yl)-4-[1-(1-oxidanidylpyridin-1-ium-4-yl)carbonylpiperidin-4-yl]phenyl]-1H-imidazole-2-carboxamide Openeye Name: 5-cyano-N-[2-(cyclohexen-1-yl)-4-[1-(1-oxidopyridin-1-ium-4-carbonyl)-4-piperidyl]phenyl]-1H-imidazole-2-carboxamide CAS Name: 5-cyano-N-[2-(1-cyclohexenyl)-4-[1-[(1-oxido-4-pyridin-1-iumyl)-oxomethyl]-4-piperidinyl]phenyl]-1H-imidazole-2-carboxamide IUPAC Name: 5-cyano-N-[2-(cyclohexen-1-yl)-4-[1-(1-oxidopyridin-1-ium-4-carbonyl)piperidin-4-yl]phenyl]-1H-imidazole-2-carboxamide Traditional Name: 5-cyano-N-[2-(cyclohexen-1-yl)-4-[1-(1-oxidopyridin-1-ium-4-carbonyl)-4-piperidyl]phenyl]-1H-imidazole-2-carboxamide Formula: C28H28N6O3 MolecularWeight: 496.56032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)C2=C(C=CC(=C2)C3CCN(CC3)C(=O)C4=CC=[N+](C=C4)[O-])NC(=O)C5=NC=C(N5)C#N

Isomeric SMILES

C1CCC(=CC1)C2=C(C=CC(=C2)C3CCN(CC3)C(=O)C4=CC=[N+](C=C4)[O-])NC(=O)C5=NC=C(N5)C#N

InChI

InChI=1S/C28H28N6O3/c29-17-23-18-30-26(31-23)27(35)32-25-7-6-22(16-24(25)20-4-2-1-3-5-20)19-8-12-33(13-9-19)28(36)21-10-14-34(37)15-11-21/h4,6-7,10-11,14-16,18-19H,1-3,5,8-9,12-13H2,(H,30,31)(H,32,35)