4-[(4-butoxyphenyl)methyl]-N-cyclopentyl-piperazin-4-ium-1-carboxamide

Systemtic Name: 4-[(4-butoxyphenyl)methyl]-N-cyclopentyl-piperazin-4-ium-1-carboxamide Openeye Name: 4-[(4-butoxyphenyl)methyl]-N-cyclopentyl-piperazin-4-ium-1-carboxamide CAS Name: 4-[(4-butoxyphenyl)methyl]-N-cyclopentyl-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[(4-butoxyphenyl)methyl]-N-cyclopentylpiperazin-4-ium-1-carboxamide Traditional Name: 4-(4-butoxybenzyl)-N-cyclopentyl-piperazin-4-ium-1-carboxamide Formula: C21H34N3O2+ MolecularWeight: 360.51356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)NC3CCCC3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)NC3CCCC3

InChI

InChI=1S/C21H33N3O2/c1-2-3-16-26-20-10-8-18(9-11-20)17-23-12-14-24(15-13-23)21(25)22-19-6-4-5-7-19/h8-11,19H,2-7,12-17H2,1H3,(H,22,25)/p+1