1-[(3-phenethyloxyphenyl)methyl]piperidin-1-ium-4-amine

Systemtic Name: 1-[(3-phenethyloxyphenyl)methyl]piperidin-1-ium-4-amine Openeye Name: 1-[(3-phenethyloxyphenyl)methyl]piperidin-1-ium-4-amine CAS Name: 1-[(3-phenethyloxyphenyl)methyl]-4-piperidin-1-iumamine IUPAC Name: 1-[(3-phenethyloxyphenyl)methyl]piperidin-1-ium-4-amine Traditional Name: [1-(3-phenethyloxybenzyl)piperidin-1-ium-4-yl]amine Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N)CC2=CC(=CC=C2)OCCC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1N)CC2=CC(=CC=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C20H26N2O/c21-19-9-12-22(13-10-19)16-18-7-4-8-20(15-18)23-14-11-17-5-2-1-3-6-17/h1-8,15,19H,9-14,16,21H2/p+1