N-butyl-N-methyl-1-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-butyl-N-methyl-1-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-benzyl-N-butyl-N-methyl-piperidin-1-ium-4-carboxamide CAS Name: N-butyl-N-methyl-1-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-benzyl-N-butyl-N-methylpiperidin-1-ium-4-carboxamide Traditional Name: 1-benzyl-N-butyl-N-methyl-piperidin-1-ium-4-carboxamide Formula: C18H29N2O+ MolecularWeight: 289.43566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

CCCCN(C)C(=O)C1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C18H28N2O/c1-3-4-12-19(2)18(21)17-10-13-20(14-11-17)15-16-8-6-5-7-9-16/h5-9,17H,3-4,10-15H2,1-2H3/p+1