N-tert-butyl-N-(1-heptanoyl-2-phenyl-imidazo[1,2-a]pyridin-4-ium-3-yl)heptanamide chloride

Systemtic Name: N-tert-butyl-N-(1-heptanoyl-2-phenyl-imidazo[1,2-a]pyridin-4-ium-3-yl)heptanamide chloride Openeye Name: N-tert-butyl-N-(1-heptanoyl-2-phenyl-imidazo[1,2-a]pyridin-4-ium-3-yl)heptanamide chloride CAS Name: N-tert-butyl-N-[1-(1-oxoheptyl)-2-phenyl-3-imidazo[1,2-a]pyridin-4-iumyl]heptanamide chloride IUPAC Name: N-tert-butyl-N-(1-heptanoyl-2-phenylimidazo[1,2-a]pyridin-4-ium-3-yl)heptanamide chloride Traditional Name: N-tert-butyl-N-(1-enanthyl-2-phenyl-imidazo[1,2-a]pyridin-4-ium-3-yl)enanthamide chloride Formula: C31H44ClN3O2 MolecularWeight: 526.15296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N1C2=CC=CC=[N+]2C(=C1C3=CC=CC=C3)N(C(=O)CCCCCC)C(C)(C)C.[Cl-]

Isomeric SMILES

CCCCCCC(=O)N1C2=CC=CC=[N+]2C(=C1C3=CC=CC=C3)N(C(=O)CCCCCC)C(C)(C)C.[Cl-]

InChI

InChI=1S/C31H44N3O2.ClH/c1-6-8-10-15-22-27(35)33-26-21-17-18-24-32(26)30(29(33)25-19-13-12-14-20-25)34(31(3,4)5)28(36)23-16-11-9-7-2;/h12-14,17-21,24H,6-11,15-16,22-23H2,1-5H3;1H/q+1;/p-1