phenyl-[4-(4-piperidin-1-ium-1-ylbutoxy)phenyl]methanone

Systemtic Name: phenyl-[4-(4-piperidin-1-ium-1-ylbutoxy)phenyl]methanone Openeye Name: phenyl-[4-(4-piperidin-1-ium-1-ylbutoxy)phenyl]methanone CAS Name: phenyl-[4-[4-(1-piperidin-1-iumyl)butoxy]phenyl]methanone IUPAC Name: phenyl-[4-(4-piperidin-1-ium-1-ylbutoxy)phenyl]methanone Traditional Name: phenyl-[4-(4-piperidin-1-ium-1-ylbutoxy)phenyl]methanone Formula: C22H28NO2+ MolecularWeight: 338.46322

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCCOC2=CC=C(C=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](CC1)CCCCOC2=CC=C(C=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H27NO2/c24-22(19-9-3-1-4-10-19)20-11-13-21(14-12-20)25-18-8-7-17-23-15-5-2-6-16-23/h1,3-4,9-14H,2,5-8,15-18H2/p+1