3-(4,5-diphenyl-1,3-oxazol-2-yl)-1-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]propan-1-one

Systemtic Name: 3-(4,5-diphenyl-1,3-oxazol-2-yl)-1-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]propan-1-one Openeye Name: 3-(4,5-diphenyloxazol-2-yl)-1-[2-(isopropylamino)pyridin-1-ium-1-yl]propan-1-one CAS Name: 3-(4,5-diphenyl-2-oxazolyl)-1-[2-(propan-2-ylamino)-1-pyridin-1-iumyl]-1-propanone IUPAC Name: 3-(4,5-diphenyl-1,3-oxazol-2-yl)-1-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]propan-1-one Traditional Name: 3-(4,5-diphenyloxazol-2-yl)-1-[2-(isopropylamino)pyridin-1-ium-1-yl]propan-1-one Formula: C26H26N3O2+ MolecularWeight: 412.50354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=CC=CC=[N+]1C(=O)CCC2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)NC1=CC=CC=[N+]1C(=O)CCC2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H25N3O2/c1-19(2)27-22-15-9-10-18-29(22)24(30)17-16-23-28-25(20-11-5-3-6-12-20)26(31-23)21-13-7-4-8-14-21/h3-15,18-19H,16-17H2,1-2H3/p+1