5,5-diphenyl-N-(4-pyrimidin-1-ium-1-ylbutyl)pent-4-enamide

Systemtic Name: 5,5-diphenyl-N-(4-pyrimidin-1-ium-1-ylbutyl)pent-4-enamide Openeye Name: 5,5-diphenyl-N-(4-pyrimidin-1-ium-1-ylbutyl)pent-4-enamide CAS Name: 5,5-diphenyl-N-[4-(1-pyrimidin-1-iumyl)butyl]-4-pentenamide IUPAC Name: 5,5-diphenyl-N-(4-pyrimidin-1-ium-1-ylbutyl)pent-4-enamide Traditional Name: 5,5-diphenyl-N-(4-pyrimidin-1-ium-1-ylbutyl)pent-4-enamide Formula: C25H28N3O+ MolecularWeight: 386.50932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CCCC(=O)NCCCC[N+]2=CC=CN=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=CCCC(=O)NCCCC[N+]2=CC=CN=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H27N3O/c29-25(27-18-7-8-19-28-20-10-17-26-21-28)16-9-15-24(22-11-3-1-4-12-22)23-13-5-2-6-14-23/h1-6,10-15,17,20-21H,7-9,16,18-19H2/p+1