1-[(4-ethylphenyl)methyl]-N-(3-methylbutyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-ethylphenyl)methyl]-N-(3-methylbutyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-ethylphenyl)methyl]-N-isopentyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-ethylphenyl)methyl]-N-(3-methylbutyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-ethylphenyl)methyl]-N-(3-methylbutyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-ethylbenzyl)-N-isoamyl-piperidin-1-ium-4-carboxamide Formula: C20H33N2O+ MolecularWeight: 317.48882

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)NCCC(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)NCCC(C)C

InChI

InChI=1S/C20H32N2O/c1-4-17-5-7-18(8-6-17)15-22-13-10-19(11-14-22)20(23)21-12-9-16(2)3/h5-8,16,19H,4,9-15H2,1-3H3,(H,21,23)/p+1