3-cyclopentyl-1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: 3-cyclopentyl-1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one Openeye Name: 3-cyclopentyl-1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one CAS Name: 3-cyclopentyl-1-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 3-cyclopentyl-1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one Traditional Name: 3-cyclopentyl-1-[4-(2,5-dimethoxybenzyl)piperazin-4-ium-1-yl]propan-1-one Formula: C21H33N2O3+ MolecularWeight: 361.49832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C[NH+]2CCN(CC2)C(=O)CCC3CCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C[NH+]2CCN(CC2)C(=O)CCC3CCCC3

InChI

InChI=1S/C21H32N2O3/c1-25-19-8-9-20(26-2)18(15-19)16-22-11-13-23(14-12-22)21(24)10-7-17-5-3-4-6-17/h8-9,15,17H,3-7,10-14,16H2,1-2H3/p+1