1-methyl-4,4-diphenyl-1-(3-phenylprop-2-ynyl)piperidin-1-ium

Systemtic Name: 1-methyl-4,4-diphenyl-1-(3-phenylprop-2-ynyl)piperidin-1-ium Openeye Name: 1-methyl-4,4-diphenyl-1-(3-phenylprop-2-ynyl)piperidin-1-ium CAS Name: 1-methyl-4,4-diphenyl-1-(3-phenylprop-2-ynyl)piperidin-1-ium IUPAC Name: 1-methyl-4,4-diphenyl-1-(3-phenylprop-2-ynyl)piperidin-1-ium Traditional Name: 1-methyl-4,4-diphenyl-1-(3-phenylprop-2-ynyl)piperidin-1-ium Formula: C27H28N+ MolecularWeight: 366.51792

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3)CC#CC4=CC=CC=C4

Isomeric SMILES

C[N+]1(CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3)CC#CC4=CC=CC=C4

InChI

InChI=1S/C27H28N/c1-28(21-11-14-24-12-5-2-6-13-24)22-19-27(20-23-28,25-15-7-3-8-16-25)26-17-9-4-10-18-26/h2-10,12-13,15-18H,19-23H2,1H3/q+1