N-butyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-butyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-butyl-1-[(4-isopropylphenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-butyl-1-[(4-propan-2-ylphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-butyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-butyl-1-(4-isopropylbenzyl)piperidin-1-ium-4-carboxamide Formula: C20H33N2O+ MolecularWeight: 317.48882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H32N2O/c1-4-5-12-21-20(23)19-10-13-22(14-11-19)15-17-6-8-18(9-7-17)16(2)3/h6-9,16,19H,4-5,10-15H2,1-3H3,(H,21,23)/p+1