3-cyclopentyl-1-[4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: 3-cyclopentyl-1-[4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one Openeye Name: 3-cyclopentyl-1-[4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one CAS Name: 3-cyclopentyl-1-[4-[(4-ethoxyphenyl)methyl]-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 3-cyclopentyl-1-[4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one Traditional Name: 3-cyclopentyl-1-[4-(4-ethoxybenzyl)piperazin-4-ium-1-yl]propan-1-one Formula: C21H33N2O2+ MolecularWeight: 345.49892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)CCC3CCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)CCC3CCCC3

InChI

InChI=1S/C21H32N2O2/c1-2-25-20-10-7-19(8-11-20)17-22-13-15-23(16-14-22)21(24)12-9-18-5-3-4-6-18/h7-8,10-11,18H,2-6,9,12-17H2,1H3/p+1