5-cyano-N-[2-(cyclohexen-1-yl)-4-[1-(1-oxidanidylpyridin-1-ium-3-yl)carbonylpiperidin-4-yl]phenyl]-1H-imidazole-2-carboxamide

Systemtic Name: 5-cyano-N-[2-(cyclohexen-1-yl)-4-[1-(1-oxidanidylpyridin-1-ium-3-yl)carbonylpiperidin-4-yl]phenyl]-1H-imidazole-2-carboxamide Openeye Name: 5-cyano-N-[2-(cyclohexen-1-yl)-4-[1-(1-oxidopyridin-1-ium-3-carbonyl)-4-piperidyl]phenyl]-1H-imidazole-2-carboxamide CAS Name: 5-cyano-N-[2-(1-cyclohexenyl)-4-[1-[(1-oxido-3-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-3-carbonyl)piperidin-4-yl]phenyl]-1H-imidazole-2-carboxamide Traditional Name: 5-cyano-N-[2-(cyclohexen-1-yl)-4-[1-(1-oxidopyridin-1-ium-3-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=C[N+](=CC=C4)[O-])NC(=O)C5=NC=C(N5)C#N

Isomeric SMILES

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

InChI

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