N-(cyclopropylmethyl)-1-[(4-methylphenyl)methyl]-N-propyl-piperidin-1-ium-4-carboxamide

Systemtic Name: N-(cyclopropylmethyl)-1-[(4-methylphenyl)methyl]-N-propyl-piperidin-1-ium-4-carboxamide Openeye Name: N-(cyclopropylmethyl)-N-propyl-1-(p-tolylmethyl)piperidin-1-ium-4-carboxamide CAS Name: N-(cyclopropylmethyl)-1-[(4-methylphenyl)methyl]-N-propyl-4-piperidin-1-iumcarboxamide IUPAC Name: N-(cyclopropylmethyl)-1-[(4-methylphenyl)methyl]-N-propylpiperidin-1-ium-4-carboxamide Traditional Name: N-(cyclopropylmethyl)-1-(4-methylbenzyl)-N-propyl-piperidin-1-ium-4-carboxamide Formula: C21H33N2O+ MolecularWeight: 329.49952

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1CC1)C(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCCN(CC1CC1)C(=O)C2CC[NH+](CC2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C21H32N2O/c1-3-12-23(16-19-8-9-19)21(24)20-10-13-22(14-11-20)15-18-6-4-17(2)5-7-18/h4-7,19-20H,3,8-16H2,1-2H3/p+1