1-[[2-(3-phenylpropoxy)phenyl]methyl]piperidin-1-ium-4-amine

Systemtic Name: 1-[[2-(3-phenylpropoxy)phenyl]methyl]piperidin-1-ium-4-amine Openeye Name: 1-[[2-(3-phenylpropoxy)phenyl]methyl]piperidin-1-ium-4-amine CAS Name: 1-[[2-(3-phenylpropoxy)phenyl]methyl]-4-piperidin-1-iumamine IUPAC Name: 1-[[2-(3-phenylpropoxy)phenyl]methyl]piperidin-1-ium-4-amine Traditional Name: [1-[2-(3-phenylpropoxy)benzyl]piperidin-1-ium-4-yl]amine Formula: C21H29N2O+ MolecularWeight: 325.46776

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N)CC2=CC=CC=C2OCCCC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1N)CC2=CC=CC=C2OCCCC3=CC=CC=C3

InChI

InChI=1S/C21H28N2O/c22-20-12-14-23(15-13-20)17-19-10-4-5-11-21(19)24-16-6-9-18-7-2-1-3-8-18/h1-5,7-8,10-11,20H,6,9,12-17,22H2/p+1