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

Systemtic Name: 1-[(3,4-diethoxyphenyl)methyl]piperidin-1-ium-4-amine Openeye Name: 1-[(3,4-diethoxyphenyl)methyl]piperidin-1-ium-4-amine CAS Name: 1-[(3,4-diethoxyphenyl)methyl]-4-piperidin-1-iumamine IUPAC Name: 1-[(3,4-diethoxyphenyl)methyl]piperidin-1-ium-4-amine Traditional Name: [1-(3,4-diethoxybenzyl)piperidin-1-ium-4-yl]amine Formula: C16H27N2O2+ MolecularWeight: 279.39778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+]2CCC(CC2)N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+]2CCC(CC2)N)OCC

InChI

InChI=1S/C16H26N2O2/c1-3-19-15-6-5-13(11-16(15)20-4-2)12-18-9-7-14(17)8-10-18/h5-6,11,14H,3-4,7-10,12,17H2,1-2H3/p+1