2,4,6-triphenyl-1-(piperidin-1-ium-4-ylmethyl)pyridin-1-ium

Systemtic Name: 2,4,6-triphenyl-1-(piperidin-1-ium-4-ylmethyl)pyridin-1-ium Openeye Name: 2,4,6-triphenyl-1-(piperidin-1-ium-4-ylmethyl)pyridin-1-ium CAS Name: 2,4,6-triphenyl-1-(4-piperidin-1-iumylmethyl)pyridin-1-ium IUPAC Name: 2,4,6-triphenyl-1-(piperidin-1-ium-4-ylmethyl)pyridin-1-ium Traditional Name: 2,4,6-triphenyl-1-(piperidin-1-ium-4-ylmethyl)pyridin-1-ium Formula: C29H30N2+2 MolecularWeight: 406.5619

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C[N+]2=C(C=C(C=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1C[NH2+]CCC1C[N+]2=C(C=C(C=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H29N2/c1-4-10-24(11-5-1)27-20-28(25-12-6-2-7-13-25)31(22-23-16-18-30-19-17-23)29(21-27)26-14-8-3-9-15-26/h1-15,20-21,23,30H,16-19,22H2/q+1/p+1