phenyl-[4-[1-[2-(4-pyridin-4-ylpyridin-1-ium-1-yl)cyclopropyl]propyl]phenyl]methanone

Systemtic Name: phenyl-[4-[1-[2-(4-pyridin-4-ylpyridin-1-ium-1-yl)cyclopropyl]propyl]phenyl]methanone Openeye Name: phenyl-[4-[1-[2-[4-(4-pyridyl)pyridin-1-ium-1-yl]cyclopropyl]propyl]phenyl]methanone CAS Name: phenyl-[4-[1-[2-(4-pyridin-4-yl-1-pyridin-1-iumyl)cyclopropyl]propyl]phenyl]methanone IUPAC Name: phenyl-[4-[1-[2-(4-pyridin-4-ylpyridin-1-ium-1-yl)cyclopropyl]propyl]phenyl]methanone Traditional Name: phenyl-[4-[1-[2-[4-(4-pyridyl)pyridin-1-ium-1-yl]cyclopropyl]propyl]phenyl]methanone Formula: C29H27N2O+ MolecularWeight: 419.53748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CC1[N+]2=CC=C(C=C2)C3=CC=NC=C3)C4=CC=C(C=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CCC(C1CC1[N+]2=CC=C(C=C2)C3=CC=NC=C3)C4=CC=C(C=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H27N2O/c1-2-26(23-8-10-25(11-9-23)29(32)24-6-4-3-5-7-24)27-20-28(27)31-18-14-22(15-19-31)21-12-16-30-17-13-21/h3-19,26-28H,2,20H2,1H3/q+1